1-(4-chloro-3-fluoro-2-propan-2-ylphenyl)pyrazole-4-carbonitrile;4-(4-chloro-2-propan-2-ylphenyl)-1-(difluoromethyl)pyrazole;bis(1-(4-chloro-2-propan-2-ylphenyl)-4-ethenylimidazole);bis(4-(4-chloro-2-propan-2-ylphenyl)-1-ethenylpyrazole);4-(4-chloro-2-propan-2-ylphenyl)-1-ethylpyrazole;1-(4-chloro-2-propan-2-ylphenyl)imidazole-4-carbonitrile;1-(4-chloro-2-propan-2-ylphenyl)-5-methylimidazole;4-(4-chloro-2-propan-2-ylphenyl)-1-methylpyrazole;4-(4-chloro-2-propan-2-ylphenyl)-1-phenylpyrazole;4-(4-chloro-2-propan-2-ylphenyl)-1H-pyrazole;1-(4-chloro-2-propan-2-ylphenyl)-4-(trifluoromethyl)pyrazole;4-(4-chloro-2-propan-2-ylphenyl)-1-(trifluoromethyl)pyrazole;ethane

C193H203Cl14F9N30 — CID 157364606

IUPAC1-(4-chloro-3-fluoro-2-propan-2-ylphenyl)pyrazole-4-carbonitrile;4-(4-chloro-2-propan-2-ylphenyl)-1-(difluoromethyl)pyrazole;bis(1-(4-chloro-2-propan-2-ylphenyl)-4-ethenylimidazole);bis(4-(4-chloro-2-propan-2-ylphenyl)-1-ethenylpyrazole);4-(4-chloro-2-propan-2-ylphenyl)-1-ethylpyrazole;1-(4-chloro-2-propan-2-ylphenyl)imidazole-4-carbonitrile;1-(4-chloro-2-propan-2-ylphenyl)-5-methylimidazole;4-(4-chloro-2-propan-2-ylphenyl)-1-methylpyrazole;4-(4-chloro-2-propan-2-ylphenyl)-1-phenylpyrazole;4-(4-chloro-2-propan-2-ylphenyl)-1H-pyrazole;1-(4-chloro-2-propan-2-ylphenyl)-4-(trifluoromethyl)pyrazole;4-(4-chloro-2-propan-2-ylphenyl)-1-(trifluoromethyl)pyrazole;ethane
SMILESC=Cc1cn(-c2ccc(Cl)cc2C(C)C)cn1.C=Cc1cn(-c2ccc(Cl)cc2C(C)C)cn1.C=Cn1cc(-c2ccc(Cl)cc2C(C)C)cn1.C=Cn1cc(-c2ccc(Cl)cc2C(C)C)cn1.CC.CC(C)c1c(-n2cc(C#N)cn2)ccc(Cl)c1F.CC(C)c1cc(Cl)ccc1-c1cn[nH]c1.CC(C)c1cc(Cl)ccc1-c1cnn(-c2ccccc2)c1.CC(C)c1cc(Cl)ccc1-c1cnn(C(F)(F)F)c1.CC(C)c1cc(Cl)ccc1-c1cnn(C(F)F)c1.CC(C)c1cc(Cl)ccc1-c1cnn(C)c1.CC(C)c1cc(Cl)ccc1-n1cc(C(F)(F)F)cn1.CC(C)c1cc(Cl)ccc1-n1cnc(C#N)c1.CCn1cc(-c2ccc(Cl)cc2C(C)C)cn1.Cc1cncn1-c1ccc(Cl)cc1C(C)C
InChIInChI=1S/C18H17ClN2.C14H17ClN2.4C14H15ClN2.2C13H12ClF3N2.C13H13ClF2N2.C13H11ClFN3.C13H12ClN3.2C13H15ClN2.C12H13ClN2.C2H6/c1-13(2)18-10-15(19)8-9-17(18)14-11-20-21(12-14)16-6-4-3-5-7-16;3*1-4-17-9-11(8-16-17)13-6-5-12(15)7-14(13)10(2)3;2*1-4-12-8-17(9-16-12)14-6-5-11(15)7-13(14)10(2)3;1-8(2)11-5-10(14)3-4-12(11)19-7-9(6-18-19)13(15,16)17;1-8(2)12-5-10(14)3-4-11(12)9-6-18-19(7-9)13(15,16)17;1-8(2)12-5-10(14)3-4-11(12)9-6-17-18(7-9)13(15)16;1-8(2)12-11(4-3-10(14)13(12)15)18-7-9(5-16)6-17-18;1-9(2)12-5-10(14)3-4-13(12)17-7-11(6-15)16-8-17;1-9(2)13-6-11(14)4-5-12(13)10-7-15-16(3)8-10;1-9(2)12-6-11(14)4-5-13(12)16-8-15-7-10(16)3;1-8(2)12-5-10(13)3-4-11(12)9-6-14-15-7-9;1-2/h3-13H,1-2H3;5-10H,4H2,1-3H3;4*4-10H,1H2,2-3H3;2*3-8H,1-2H3;3-8,13H,1-2H3;3-4,6-8H,1-2H3;3-5,7-9H,1-2H3;2*4-9H,1-3H3;3-8H,1-2H3,(H,14,15);1-2H3
InChIKeyBJANKEHYJZLQQD-UHFFFAOYSA-N
MW3610.28 g/mol
LogP61.18
Rot. Bonds35

About 1-(4-chloro-3-fluoro-2-propan-2-ylphenyl)pyrazole-4-carbonitrile;4-(4-chloro-2-propan-2-ylphenyl)-1-(difluoromethyl)pyrazole;bis(1-(4-chloro-2-propan-2-ylphenyl)-4-ethenylimidazole);bis(4-(4-chloro-2-propan-2-ylphenyl)-1-ethenylpyrazole);4-(4-chloro-2-propan-2-ylphenyl)-1-ethylpyrazole;1-(4-chloro-2-propan-2-ylphenyl)imidazole-4-carbonitrile;1-(4-chloro-2-propan-2-ylphenyl)-5-methylimidazole;4-(4-chloro-2-propan-2-ylphenyl)-1-methylpyrazole;4-(4-chloro-2-propan-2-ylphenyl)-1-phenylpyrazole;4-(4-chloro-2-propan-2-ylphenyl)-1H-pyrazole;1-(4-chloro-2-propan-2-ylphenyl)-4-(trifluoromethyl)pyrazole;4-(4-chloro-2-propan-2-ylphenyl)-1-(trifluoromethyl)pyrazole;ethane

1-(4-chloro-3-fluoro-2-propan-2-ylphenyl)pyrazole-4-carbonitrile;4-(4-chloro-2-propan-2-ylphenyl)-1-(difluoromethyl)pyrazole;bis(1-(4-chloro-2-propan-2-ylphenyl)-4-ethenylimidazole);bis(4-(4-chloro-2-propan-2-ylphenyl)-1-ethenylpyrazole);4-(4-chloro-2-propan-2-ylphenyl)-1-ethylpyrazole;1-(4-chloro-2-propan-2-ylphenyl)imidazole-4-carbonitrile;1-(4-chloro-2-propan-2-ylphenyl)-5-methylimidazole;4-(4-chloro-2-propan-2-ylphenyl)-1-methylpyrazole;4-(4-chloro-2-propan-2-ylphenyl)-1-phenylpyrazole;4-(4-chloro-2-propan-2-ylphenyl)-1H-pyrazole;1-(4-chloro-2-propan-2-ylphenyl)-4-(trifluoromethyl)pyrazole;4-(4-chloro-2-propan-2-ylphenyl)-1-(trifluoromethyl)pyrazole;ethane (PubChem CID 157364606) has the molecular formula C193H203Cl14F9N30 and a molecular weight of 3610.28 g/mol. Its IUPAC name is 1-(4-chloro-3-fluoro-2-propan-2-ylphenyl)pyrazole-4-carbonitrile;4-(4-chloro-2-propan-2-ylphenyl)-1-(difluoromethyl)pyrazole;bis(1-(4-chloro-2-propan-2-ylphenyl)-4-ethenylimidazole);bis(4-(4-chloro-2-propan-2-ylphenyl)-1-ethenylpyrazole);4-(4-chloro-2-propan-2-ylphenyl)-1-ethylpyrazole;1-(4-chloro-2-propan-2-ylphenyl)imidazole-4-carbonitrile;1-(4-chloro-2-propan-2-ylphenyl)-5-methylimidazole;4-(4-chloro-2-propan-2-ylphenyl)-1-methylpyrazole;4-(4-chloro-2-propan-2-ylphenyl)-1-phenylpyrazole;4-(4-chloro-2-propan-2-ylphenyl)-1H-pyrazole;1-(4-chloro-2-propan-2-ylphenyl)-4-(trifluoromethyl)pyrazole;4-(4-chloro-2-propan-2-ylphenyl)-1-(trifluoromethyl)pyrazole;ethane.

Molecular Properties

Compound Name1-(4-chloro-3-fluoro-2-propan-2-ylphenyl)pyrazole-4-carbonitrile;4-(4-chloro-2-propan-2-ylphenyl)-1-(difluoromethyl)pyrazole;bis(1-(4-chloro-2-propan-2-ylphenyl)-4-ethenylimidazole);bis(4-(4-chloro-2-propan-2-ylphenyl)-1-ethenylpyrazole);4-(4-chloro-2-propan-2-ylphenyl)-1-ethylpyrazole;1-(4-chloro-2-propan-2-ylphenyl)imidazole-4-carbonitrile;1-(4-chloro-2-propan-2-ylphenyl)-5-methylimidazole;4-(4-chloro-2-propan-2-ylphenyl)-1-methylpyrazole;4-(4-chloro-2-propan-2-ylphenyl)-1-phenylpyrazole;4-(4-chloro-2-propan-2-ylphenyl)-1H-pyrazole;1-(4-chloro-2-propan-2-ylphenyl)-4-(trifluoromethyl)pyrazole;4-(4-chloro-2-propan-2-ylphenyl)-1-(trifluoromethyl)pyrazole;ethane
PubChem CID157364606
Molecular FormulaC193H203Cl14F9N30
Molecular Weight3610.28 g/mol
Exact Mass3601.23
IUPAC Name1-(4-chloro-3-fluoro-2-propan-2-ylphenyl)pyrazole-4-carbonitrile;4-(4-chloro-2-propan-2-ylphenyl)-1-(difluoromethyl)pyrazole;bis(1-(4-chloro-2-propan-2-ylphenyl)-4-ethenylimidazole);bis(4-(4-chloro-2-propan-2-ylphenyl)-1-ethenylpyrazole);4-(4-chloro-2-propan-2-ylphenyl)-1-ethylpyrazole;1-(4-chloro-2-propan-2-ylphenyl)imidazole-4-carbonitrile;1-(4-chloro-2-propan-2-ylphenyl)-5-methylimidazole;4-(4-chloro-2-propan-2-ylphenyl)-1-methylpyrazole;4-(4-chloro-2-propan-2-ylphenyl)-1-phenylpyrazole;4-(4-chloro-2-propan-2-ylphenyl)-1H-pyrazole;1-(4-chloro-2-propan-2-ylphenyl)-4-(trifluoromethyl)pyrazole;4-(4-chloro-2-propan-2-ylphenyl)-1-(trifluoromethyl)pyrazole;ethane
SMILESC=Cc1cn(-c2ccc(Cl)cc2C(C)C)cn1.C=Cc1cn(-c2ccc(Cl)cc2C(C)C)cn1.C=Cn1cc(-c2ccc(Cl)cc2C(C)C)cn1.C=Cn1cc(-c2ccc(Cl)cc2C(C)C)cn1.CC.CC(C)c1c(-n2cc(C#N)cn2)ccc(Cl)c1F.CC(C)c1cc(Cl)ccc1-c1cn[nH]c1.CC(C)c1cc(Cl)ccc1-c1cnn(-c2ccccc2)c1.CC(C)c1cc(Cl)ccc1-c1cnn(C(F)(F)F)c1.CC(C)c1cc(Cl)ccc1-c1cnn(C(F)F)c1.CC(C)c1cc(Cl)ccc1-c1cnn(C)c1.CC(C)c1cc(Cl)ccc1-n1cc(C(F)(F)F)cn1.CC(C)c1cc(Cl)ccc1-n1cnc(C#N)c1.CCn1cc(-c2ccc(Cl)cc2C(C)C)cn1.Cc1cncn1-c1ccc(Cl)cc1C(C)C
InChIInChI=1S/C18H17ClN2.C14H17ClN2.4C14H15ClN2.2C13H12ClF3N2.C13H13ClF2N2.C13H11ClFN3.C13H12ClN3.2C13H15ClN2.C12H13ClN2.C2H6/c1-13(2)18-10-15(19)8-9-17(18)14-11-20-21(12-14)16-6-4-3-5-7-16;3*1-4-17-9-11(8-16-17)13-6-5-12(15)7-14(13)10(2)3;2*1-4-12-8-17(9-16-12)14-6-5-11(15)7-13(14)10(2)3;1-8(2)11-5-10(14)3-4-12(11)19-7-9(6-18-19)13(15,16)17;1-8(2)12-5-10(14)3-4-11(12)9-6-18-19(7-9)13(15,16)17;1-8(2)12-5-10(14)3-4-11(12)9-6-17-18(7-9)13(15)16;1-8(2)12-11(4-3-10(14)13(12)15)18-7-9(5-16)6-17-18;1-9(2)12-5-10(14)3-4-13(12)17-7-11(6-15)16-8-17;1-9(2)13-6-11(14)4-5-12(13)10-7-15-16(3)8-10;1-9(2)12-6-11(14)4-5-13(12)16-8-15-7-10(16)3;1-8(2)12-5-10(13)3-4-11(12)9-6-14-15-7-9;1-2/h3-13H,1-2H3;5-10H,4H2,1-3H3;4*4-10H,1H2,2-3H3;2*3-8H,1-2H3;3-8,13H,1-2H3;3-4,6-8H,1-2H3;3-5,7-9H,1-2H3;2*4-9H,1-3H3;3-8H,1-2H3,(H,14,15);1-2H3
InChIKeyBJANKEHYJZLQQD-UHFFFAOYSA-N
XLogP61.18
TPSA307.92 Ų
H-Bond Donors1
H-Bond Acceptors29
Rotatable Bonds35
Heavy Atoms246
Complexity—

Lipinski Rule of Five

3 violations

RuleValue
MW ≤ 5003610.28
LogP ≤ 561.18
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 1029

Analyze 1-(4-chloro-3-fluoro-2-propan-2-ylphenyl)pyrazole-4-carbonitrile;4-(4-chloro-2-propan-2-ylphenyl)-1-(difluoromethyl)pyrazole;bis(1-(4-chloro-2-propan-2-ylphenyl)-4-ethenylimidazole);bis(4-(4-chloro-2-propan-2-ylphenyl)-1-ethenylpyrazole);4-(4-chloro-2-propan-2-ylphenyl)-1-ethylpyrazole;1-(4-chloro-2-propan-2-ylphenyl)imidazole-4-carbonitrile;1-(4-chloro-2-propan-2-ylphenyl)-5-methylimidazole;4-(4-chloro-2-propan-2-ylphenyl)-1-methylpyrazole;4-(4-chloro-2-propan-2-ylphenyl)-1-phenylpyrazole;4-(4-chloro-2-propan-2-ylphenyl)-1H-pyrazole;1-(4-chloro-2-propan-2-ylphenyl)-4-(trifluoromethyl)pyrazole;4-(4-chloro-2-propan-2-ylphenyl)-1-(trifluoromethyl)pyrazole;ethane with MolForge

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Related Compounds

4-chloro-1-(4-chloro-3-fluoro-2-propan-2-ylphenyl)triazole;4-chloro-1-(4-chloro-2-propan-2-ylphenyl)triazole;1-(4-chloro-3-fluoro-2-propan-2-ylphenyl)pyrazole-4-carbonitrile;1-(4-chloro-3-fluoro-2-propan-2-ylphenyl)triazole;1-(4-chloro-3-fluoro-2-propan-2-ylphenyl)triazole-4-carbonitrile;4-(4-chloro-2-propan-2-ylphenyl)-1-(difluoromethyl)-1,2,4-triazol-4-ium;bis(1-(4-chloro-2-propan-2-ylphenyl)-4-ethenylimidazole);bis(4-(4-chloro-2-propan-2-ylphenyl)-1-ethenylpyrazole);4-(4-chloro-2-propan-2-ylphenyl)-1-ethyl-1,2,4-triazol-4-ium;1-(4-chloro-2-propan-2-ylphenyl)imidazole-4-carbonitrile;1-(4-chloro-2-propan-2-ylphenyl)-5-methylimidazole;4-(4-chloro-2-propan-2-ylphenyl)-1-methyl-1,2,4-triazol-4-ium;4-(4-chloro-2-propan-2-ylphenyl)-1-phenylpyrazole;4-(4-chloro-2-propan-2-ylphenyl)-1H-pyrazole;4-(4-chloro-2-propan-2-ylphenyl)-1-(trifluoromethyl)-1,2,4-triazol-4-ium;ethane
CID 157477305
Bis(1-(4-chloro-3-fluoro-2-propan-2-ylphenyl)-4-ethenylpyrazole);1-(4-chloro-3-fluoro-2-propan-2-ylphenyl)tetrazole;1-(4-chloro-3-fluoro-2-propan-2-ylphenyl)-1,2,4-triazole;1-(4-chloro-3-fluoro-2-propan-2-ylphenyl)-4-(trifluoromethyl)pyrazole;1-(4-chloro-2-propan-2-ylphenyl)-3,4-dimethylpyrazole;1-(4-chloro-2-propan-2-ylphenyl)-4-ethenyl-3-methylpyrazole;tetrakis(1-(4-chloro-2-propan-2-ylphenyl)-4-ethenylpyrazole);1-(4-chloro-2-propan-2-ylphenyl)imidazole;1-(4-chloro-2-propan-2-ylphenyl)-4-methylimidazole;1-(4-chloro-2-propan-2-ylphenyl)triazole;1-(4-chloro-2-propan-2-ylphenyl)-4-(trifluoromethyl)imidazole;1-(4-chloro-2-propan-2-ylphenyl)-4-(trifluoromethyl)pyrazole
CID 157567724
4-Chloro-1-(4-chloro-3-fluoro-2-propan-2-ylphenyl)triazole;4-chloro-1-(4-chloro-2-propan-2-ylphenyl)triazole;1-(4-chloro-3-fluoro-2-propan-2-ylphenyl)-4-cyclopropyltriazole;bis(1-(4-chloro-3-fluoro-2-propan-2-ylphenyl)-4-methyltriazole);1-(4-chloro-3-fluoro-2-propan-2-ylphenyl)-4-phenyltriazole;1-(4-chloro-3-fluoro-2-propan-2-ylphenyl)tetrazole;1-(4-chloro-3-fluoro-2-propan-2-ylphenyl)triazole;1-(4-chloro-3-fluoro-2-propan-2-ylphenyl)-1,2,4-triazole;1-(4-chloro-3-fluoro-2-propan-2-ylphenyl)triazole-4-carbonitrile;1-(4-chloro-3-fluoro-2-propan-2-ylphenyl)-4-(trifluoromethyl)triazole;1-(4-chloro-2-propan-2-ylphenyl)-4-cyclopropyltriazole;bis(1-(4-chloro-2-propan-2-ylphenyl)-4-methyltriazole);1-(4-chloro-2-propan-2-ylphenyl)triazole;1-(4-chloro-2-propan-2-ylphenyl)triazole-4-carbonitrile;1-(4-chloro-2-propan-2-ylphenyl)-4-(trifluoromethyl)triazole
CID 158255452
4-chloro-1-(4-chloro-3-fluoro-2-propan-2-ylphenyl)triazole;1-(4-chloro-3-fluoro-2-propan-2-ylphenyl)triazole;4-(4-chloro-2-propan-2-ylphenyl)-1-(difluoromethyl)pyrazole;bis(4-(4-chloro-2-propan-2-ylphenyl)-1-ethenylpyrazole);4-(4-chloro-2-propan-2-ylphenyl)-1-ethylpyrazole;4-(4-chloro-2-propan-2-ylphenyl)-1-methylpyrazole;4-(4-chloro-2-propan-2-ylphenyl)-1-phenylpyrazole;4-(4-chloro-2-propan-2-ylphenyl)-1H-pyrazole;4-(4-chloro-2-propan-2-ylphenyl)-1-(trifluoromethyl)pyrazole;ethane
CID 158368975
CID 158457823
CID 158457823
4-chloro-1-(4-chloro-3-fluoro-2-propan-2-ylphenyl)triazole;4-chloro-1-(4-chloro-2-propan-2-ylphenyl)triazole;1-(4-chloro-3-fluoro-2-propan-2-ylphenyl)-4-cyclopropyltriazole;bis(1-(4-chloro-3-fluoro-2-propan-2-ylphenyl)-4-methyltriazole);1-(4-chloro-3-fluoro-2-propan-2-ylphenyl)triazole;1-(4-chloro-3-fluoro-2-propan-2-ylphenyl)triazole-4-carbonitrile;1-(4-chloro-3-fluoro-2-propan-2-ylphenyl)-4-(trifluoromethyl)triazole;1-(4-chloro-2-propan-2-ylphenyl)-4-cyclopropyltriazole;bis(1-(4-chloro-2-propan-2-ylphenyl)-4-methyltriazole);4-(4-chloro-2-propan-2-ylphenyl)-1-phenylpyrazole;4-(4-chloro-2-propan-2-ylphenyl)-1H-pyrazole;1-(4-chloro-2-propan-2-ylphenyl)triazole-4-carbonitrile;1-(4-chloro-2-propan-2-ylphenyl)-4-(trifluoromethyl)triazole;ethane
CID 158594741
4-chloro-1-(4-chloro-3-fluoro-2-propan-2-ylphenyl)triazole;4-chloro-1-(4-chloro-2-propan-2-ylphenyl)triazole;1-(4-chloro-3-fluoro-2-propan-2-ylphenyl)-4-cyclopropyltriazole;1-(4-chloro-3-fluoro-2-propan-2-ylphenyl)triazole;1-(4-chloro-3-fluoro-2-propan-2-ylphenyl)triazole-4-carbonitrile;1-(4-chloro-3-fluoro-2-propan-2-ylphenyl)-4-(trifluoromethyl)triazole;bis(4-(4-chloro-2-propan-2-ylphenyl)-1-ethenylpyrazole);4-(4-chloro-2-propan-2-ylphenyl)-1-phenylpyrazole;4-(4-chloro-2-propan-2-ylphenyl)-1H-pyrazole;1-(4-chloro-2-propan-2-ylphenyl)triazole-4-carbonitrile;4-(4-chloro-2-propan-2-ylphenyl)-1-(trifluoromethyl)pyrazole;1-(4-chloro-2-propan-2-ylphenyl)-4-(trifluoromethyl)triazole;ethane
CID 158655157
4-Chloro-1-(4-chloro-3-fluoro-2-propan-2-ylphenyl)imidazole;4-chloro-1-(4-chloro-3-fluoro-2-propan-2-ylphenyl)pyrazole;4-chloro-1-(4-chloro-2-propan-2-ylphenyl)imidazole;4-chloro-1-(4-chloro-2-propan-2-ylphenyl)pyrazole;1-(4-chloro-3-fluoro-2-propan-2-ylphenyl)-4-methylpyrazole;1-(4-chloro-3-fluoro-2-propan-2-ylphenyl)pyrazole-4-carboxylic acid;4-(4-chloro-2-propan-2-ylphenyl)-1-(difluoromethyl)pyrazole;bis(1-(4-chloro-2-propan-2-ylphenyl)-4-methylpyrazole);1-(4-chloro-2-propan-2-ylphenyl)-4-methyltriazole;1-(4-chloro-2-propan-2-ylphenyl)-4-(trifluoromethyl)pyrazole;methane
CID 158723604
1-(4-Chloro-3-fluoro-2-propan-2-ylphenyl)-4-ethenylpyrazole;1-(4-chloro-3-fluoro-2-propan-2-ylphenyl)-4-methylsulfonylpyrazole;1-(4-chloro-3-fluoro-2-propan-2-ylphenyl)pyrazole-4-carbonitrile;1-(4-chloro-3-fluoro-2-propan-2-ylphenyl)-4-(trifluoromethyl)pyrazole;4-(4-chloro-2-propan-2-ylphenyl)-1-(difluoromethyl)pyrazole;1-(4-chloro-2-propan-2-ylphenyl)-3,4-dimethylpyrazole;bis(1-(4-chloro-2-propan-2-ylphenyl)-4-ethenylimidazole);4-(4-chloro-2-propan-2-ylphenyl)-1-ethylpyrazole;1-(4-chloro-2-propan-2-ylphenyl)imidazole-4-carbonitrile;1-(4-chloro-2-propan-2-ylphenyl)-5-methylimidazole;4-(4-chloro-2-propan-2-ylphenyl)-1-methylpyrazole;1-(4-chloro-2-propan-2-ylphenyl)-4-methylsulfonylpyrazole;1-(4-chloro-2-propan-2-ylphenyl)-4-(trifluoromethyl)pyrazole;4-(4-chloro-2-propan-2-ylphenyl)-1-(trifluoromethyl)pyrazole
CID 158853759
4-chloro-1-(4-chloro-3-fluoro-2-propan-2-ylphenyl)triazole;4-chloro-1-(4-chloro-2-propan-2-ylphenyl)triazole;1-(4-chloro-3-fluoro-2-propan-2-ylphenyl)-4-cyclopropyltriazole;1-(4-chloro-3-fluoro-2-propan-2-ylphenyl)triazole;1-(4-chloro-3-fluoro-2-propan-2-ylphenyl)triazole-4-carbonitrile;1-(4-chloro-3-fluoro-2-propan-2-ylphenyl)-4-(trifluoromethyl)triazole;1-(4-chloro-2-propan-2-ylphenyl)-4-cyclopropyltriazole;bis(4-(4-chloro-2-propan-2-ylphenyl)-1-ethenylpyrazole);4-(4-chloro-2-propan-2-ylphenyl)-1-phenylpyrazole;4-(4-chloro-2-propan-2-ylphenyl)-1H-pyrazole;1-(4-chloro-2-propan-2-ylphenyl)triazole-4-carbonitrile;1-(4-chloro-2-propan-2-ylphenyl)-4-(trifluoromethyl)triazole;ethane
CID 158960436
1-(4-Chloro-3-fluoro-2-propan-2-ylphenyl)-4-ethenylpyrazole;1-(4-chloro-3-fluoro-2-propan-2-ylphenyl)-4-methylpyrazole;1-(4-chloro-3-fluoro-2-propan-2-ylphenyl)pyrazole-4-carbonitrile;1-(4-chloro-3-fluoro-2-propan-2-ylphenyl)-4-(trifluoromethyl)pyrazole;1-(4-chloro-2-propan-2-ylphenyl)-3,4-dimethylpyrazole;bis(1-(4-chloro-2-propan-2-ylphenyl)-4-ethenylimidazole);1-(4-chloro-2-propan-2-ylphenyl)-4-ethenylpyrazole;1-(4-chloro-2-propan-2-ylphenyl)-4-methylpyrazole;1-(4-chloro-2-propan-2-ylphenyl)pyrazole-4-carbonitrile;1-(4-chloro-2-propan-2-ylphenyl)-4-(trifluoromethyl)pyrazole
CID 159025856
1-(4-chloro-2,5-dimethylphenyl)pyrrole;1-(5-chloro-2,4-dimethylphenyl)pyrrole;1-methyl-3-propan-2-ylbenzene;1-[2-methyl-4-(trifluoromethyl)phenyl]pyrazole;1-[2-methyl-4-(trifluoromethyl)phenyl]pyrrole;5-[2-methyl-4-(trifluoromethyl)phenyl]-5H-tetrazole;1-[2-methyl-4-(trifluoromethyl)phenyl]triazole;1-[2-methyl-4-(trifluoromethyl)phenyl]-1,2,4-triazole
CID 159205993

Frequently Asked Questions

What is the IUPAC name of 1-(4-chloro-3-fluoro-2-propan-2-ylphenyl)pyrazole-4-carbonitrile;4-(4-chloro-2-propan-2-ylphenyl)-1-(difluoromethyl)pyrazole;bis(1-(4-chloro-2-propan-2-ylphenyl)-4-ethenylimidazole);bis(4-(4-chloro-2-propan-2-ylphenyl)-1-ethenylpyrazole);4-(4-chloro-2-propan-2-ylphenyl)-1-ethylpyrazole;1-(4-chloro-2-propan-2-ylphenyl)imidazole-4-carbonitrile;1-(4-chloro-2-propan-2-ylphenyl)-5-methylimidazole;4-(4-chloro-2-propan-2-ylphenyl)-1-methylpyrazole;4-(4-chloro-2-propan-2-ylphenyl)-1-phenylpyrazole;4-(4-chloro-2-propan-2-ylphenyl)-1H-pyrazole;1-(4-chloro-2-propan-2-ylphenyl)-4-(trifluoromethyl)pyrazole;4-(4-chloro-2-propan-2-ylphenyl)-1-(trifluoromethyl)pyrazole;ethane?
The IUPAC name of 1-(4-chloro-3-fluoro-2-propan-2-ylphenyl)pyrazole-4-carbonitrile;4-(4-chloro-2-propan-2-ylphenyl)-1-(difluoromethyl)pyrazole;bis(1-(4-chloro-2-propan-2-ylphenyl)-4-ethenylimidazole);bis(4-(4-chloro-2-propan-2-ylphenyl)-1-ethenylpyrazole);4-(4-chloro-2-propan-2-ylphenyl)-1-ethylpyrazole;1-(4-chloro-2-propan-2-ylphenyl)imidazole-4-carbonitrile;1-(4-chloro-2-propan-2-ylphenyl)-5-methylimidazole;4-(4-chloro-2-propan-2-ylphenyl)-1-methylpyrazole;4-(4-chloro-2-propan-2-ylphenyl)-1-phenylpyrazole;4-(4-chloro-2-propan-2-ylphenyl)-1H-pyrazole;1-(4-chloro-2-propan-2-ylphenyl)-4-(trifluoromethyl)pyrazole;4-(4-chloro-2-propan-2-ylphenyl)-1-(trifluoromethyl)pyrazole;ethane (CID 157364606) is 1-(4-chloro-3-fluoro-2-propan-2-ylphenyl)pyrazole-4-carbonitrile;4-(4-chloro-2-propan-2-ylphenyl)-1-(difluoromethyl)pyrazole;bis(1-(4-chloro-2-propan-2-ylphenyl)-4-ethenylimidazole);bis(4-(4-chloro-2-propan-2-ylphenyl)-1-ethenylpyrazole);4-(4-chloro-2-propan-2-ylphenyl)-1-ethylpyrazole;1-(4-chloro-2-propan-2-ylphenyl)imidazole-4-carbonitrile;1-(4-chloro-2-propan-2-ylphenyl)-5-methylimidazole;4-(4-chloro-2-propan-2-ylphenyl)-1-methylpyrazole;4-(4-chloro-2-propan-2-ylphenyl)-1-phenylpyrazole;4-(4-chloro-2-propan-2-ylphenyl)-1H-pyrazole;1-(4-chloro-2-propan-2-ylphenyl)-4-(trifluoromethyl)pyrazole;4-(4-chloro-2-propan-2-ylphenyl)-1-(trifluoromethyl)pyrazole;ethane.
What is the SMILES notation for 1-(4-chloro-3-fluoro-2-propan-2-ylphenyl)pyrazole-4-carbonitrile;4-(4-chloro-2-propan-2-ylphenyl)-1-(difluoromethyl)pyrazole;bis(1-(4-chloro-2-propan-2-ylphenyl)-4-ethenylimidazole);bis(4-(4-chloro-2-propan-2-ylphenyl)-1-ethenylpyrazole);4-(4-chloro-2-propan-2-ylphenyl)-1-ethylpyrazole;1-(4-chloro-2-propan-2-ylphenyl)imidazole-4-carbonitrile;1-(4-chloro-2-propan-2-ylphenyl)-5-methylimidazole;4-(4-chloro-2-propan-2-ylphenyl)-1-methylpyrazole;4-(4-chloro-2-propan-2-ylphenyl)-1-phenylpyrazole;4-(4-chloro-2-propan-2-ylphenyl)-1H-pyrazole;1-(4-chloro-2-propan-2-ylphenyl)-4-(trifluoromethyl)pyrazole;4-(4-chloro-2-propan-2-ylphenyl)-1-(trifluoromethyl)pyrazole;ethane?
The canonical SMILES for 1-(4-chloro-3-fluoro-2-propan-2-ylphenyl)pyrazole-4-carbonitrile;4-(4-chloro-2-propan-2-ylphenyl)-1-(difluoromethyl)pyrazole;bis(1-(4-chloro-2-propan-2-ylphenyl)-4-ethenylimidazole);bis(4-(4-chloro-2-propan-2-ylphenyl)-1-ethenylpyrazole);4-(4-chloro-2-propan-2-ylphenyl)-1-ethylpyrazole;1-(4-chloro-2-propan-2-ylphenyl)imidazole-4-carbonitrile;1-(4-chloro-2-propan-2-ylphenyl)-5-methylimidazole;4-(4-chloro-2-propan-2-ylphenyl)-1-methylpyrazole;4-(4-chloro-2-propan-2-ylphenyl)-1-phenylpyrazole;4-(4-chloro-2-propan-2-ylphenyl)-1H-pyrazole;1-(4-chloro-2-propan-2-ylphenyl)-4-(trifluoromethyl)pyrazole;4-(4-chloro-2-propan-2-ylphenyl)-1-(trifluoromethyl)pyrazole;ethane is C=Cc1cn(-c2ccc(Cl)cc2C(C)C)cn1.C=Cc1cn(-c2ccc(Cl)cc2C(C)C)cn1.C=Cn1cc(-c2ccc(Cl)cc2C(C)C)cn1.C=Cn1cc(-c2ccc(Cl)cc2C(C)C)cn1.CC.CC(C)c1c(-n2cc(C#N)cn2)ccc(Cl)c1F.CC(C)c1cc(Cl)ccc1-c1cn[nH]c1.CC(C)c1cc(Cl)ccc1-c1cnn(-c2ccccc2)c1.CC(C)c1cc(Cl)ccc1-c1cnn(C(F)(F)F)c1.CC(C)c1cc(Cl)ccc1-c1cnn(C(F)F)c1.CC(C)c1cc(Cl)ccc1-c1cnn(C)c1.CC(C)c1cc(Cl)ccc1-n1cc(C(F)(F)F)cn1.CC(C)c1cc(Cl)ccc1-n1cnc(C#N)c1.CCn1cc(-c2ccc(Cl)cc2C(C)C)cn1.Cc1cncn1-c1ccc(Cl)cc1C(C)C.
What is the InChIKey of 1-(4-chloro-3-fluoro-2-propan-2-ylphenyl)pyrazole-4-carbonitrile;4-(4-chloro-2-propan-2-ylphenyl)-1-(difluoromethyl)pyrazole;bis(1-(4-chloro-2-propan-2-ylphenyl)-4-ethenylimidazole);bis(4-(4-chloro-2-propan-2-ylphenyl)-1-ethenylpyrazole);4-(4-chloro-2-propan-2-ylphenyl)-1-ethylpyrazole;1-(4-chloro-2-propan-2-ylphenyl)imidazole-4-carbonitrile;1-(4-chloro-2-propan-2-ylphenyl)-5-methylimidazole;4-(4-chloro-2-propan-2-ylphenyl)-1-methylpyrazole;4-(4-chloro-2-propan-2-ylphenyl)-1-phenylpyrazole;4-(4-chloro-2-propan-2-ylphenyl)-1H-pyrazole;1-(4-chloro-2-propan-2-ylphenyl)-4-(trifluoromethyl)pyrazole;4-(4-chloro-2-propan-2-ylphenyl)-1-(trifluoromethyl)pyrazole;ethane?
The InChIKey is BJANKEHYJZLQQD-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H17ClN2.C14H17ClN2.4C14H15ClN2.2C13H12ClF3N2.C13H13ClF2N2.C13H11ClFN3.C13H12ClN3.2C13H15ClN2.C12H13ClN2.C2H6/c1-13(2)18-10-15(19)8-9-17(18)14-11-20-21(12-14)16-6-4-3-5-7-16;3*1-4-17-9-11(8-16-17)13-6-5-12(15)7-14(13)10(2)3;2*1-4-12-8-17(9-16-12)14-6-5-11(15)7-13(14)10(2)3;1-8(2)11-5-10(14)3-4-12(11)19-7-9(6-18-19)13(15,16)17;1-8(2)12-5-10(14)3-4-11(12)9-6-18-19(7-9)13(15,16)17;1-8(2)12-5-10(14)3-4-11(12)9-6-17-18(7-9)13(15)16;1-8(2)12-11(4-3-10(14)13(12)15)18-7-9(5-16)6-17-18;1-9(2)12-5-10(14)3-4-13(12)17-7-11(6-15)16-8-17;1-9(2)13-6-11(14)4-5-12(13)10-7-15-16(3)8-10;1-9(2)12-6-11(14)4-5-13(12)16-8-15-7-10(16)3;1-8(2)12-5-10(13)3-4-11(12)9-6-14-15-7-9;1-2/h3-13H,1-2H3;5-10H,4H2,1-3H3;4*4-10H,1H2,2-3H3;2*3-8H,1-2H3;3-8,13H,1-2H3;3-4,6-8H,1-2H3;3-5,7-9H,1-2H3;2*4-9H,1-3H3;3-8H,1-2H3,(H,14,15);1-2H3.
What are the key properties of 1-(4-chloro-3-fluoro-2-propan-2-ylphenyl)pyrazole-4-carbonitrile;4-(4-chloro-2-propan-2-ylphenyl)-1-(difluoromethyl)pyrazole;bis(1-(4-chloro-2-propan-2-ylphenyl)-4-ethenylimidazole);bis(4-(4-chloro-2-propan-2-ylphenyl)-1-ethenylpyrazole);4-(4-chloro-2-propan-2-ylphenyl)-1-ethylpyrazole;1-(4-chloro-2-propan-2-ylphenyl)imidazole-4-carbonitrile;1-(4-chloro-2-propan-2-ylphenyl)-5-methylimidazole;4-(4-chloro-2-propan-2-ylphenyl)-1-methylpyrazole;4-(4-chloro-2-propan-2-ylphenyl)-1-phenylpyrazole;4-(4-chloro-2-propan-2-ylphenyl)-1H-pyrazole;1-(4-chloro-2-propan-2-ylphenyl)-4-(trifluoromethyl)pyrazole;4-(4-chloro-2-propan-2-ylphenyl)-1-(trifluoromethyl)pyrazole;ethane?
1-(4-chloro-3-fluoro-2-propan-2-ylphenyl)pyrazole-4-carbonitrile;4-(4-chloro-2-propan-2-ylphenyl)-1-(difluoromethyl)pyrazole;bis(1-(4-chloro-2-propan-2-ylphenyl)-4-ethenylimidazole);bis(4-(4-chloro-2-propan-2-ylphenyl)-1-ethenylpyrazole);4-(4-chloro-2-propan-2-ylphenyl)-1-ethylpyrazole;1-(4-chloro-2-propan-2-ylphenyl)imidazole-4-carbonitrile;1-(4-chloro-2-propan-2-ylphenyl)-5-methylimidazole;4-(4-chloro-2-propan-2-ylphenyl)-1-methylpyrazole;4-(4-chloro-2-propan-2-ylphenyl)-1-phenylpyrazole;4-(4-chloro-2-propan-2-ylphenyl)-1H-pyrazole;1-(4-chloro-2-propan-2-ylphenyl)-4-(trifluoromethyl)pyrazole;4-(4-chloro-2-propan-2-ylphenyl)-1-(trifluoromethyl)pyrazole;ethane has a molecular weight of 3610.28 g/mol, XLogP of 61.18, 35 rotatable bonds, 1 hydrogen bond donors, and 29 hydrogen bond acceptors.
Where does this data come from?
All data for 1-(4-chloro-3-fluoro-2-propan-2-ylphenyl)pyrazole-4-carbonitrile;4-(4-chloro-2-propan-2-ylphenyl)-1-(difluoromethyl)pyrazole;bis(1-(4-chloro-2-propan-2-ylphenyl)-4-ethenylimidazole);bis(4-(4-chloro-2-propan-2-ylphenyl)-1-ethenylpyrazole);4-(4-chloro-2-propan-2-ylphenyl)-1-ethylpyrazole;1-(4-chloro-2-propan-2-ylphenyl)imidazole-4-carbonitrile;1-(4-chloro-2-propan-2-ylphenyl)-5-methylimidazole;4-(4-chloro-2-propan-2-ylphenyl)-1-methylpyrazole;4-(4-chloro-2-propan-2-ylphenyl)-1-phenylpyrazole;4-(4-chloro-2-propan-2-ylphenyl)-1H-pyrazole;1-(4-chloro-2-propan-2-ylphenyl)-4-(trifluoromethyl)pyrazole;4-(4-chloro-2-propan-2-ylphenyl)-1-(trifluoromethyl)pyrazole;ethane is sourced from PubChem (CID 157364606), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).