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)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

C185H186Cl17F14N47 — CID 160749559

IUPAC4-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)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
SMILESCC(C)c1c(-n2cc(-c3ccccc3)nn2)ccc(Cl)c1F.CC(C)c1c(-n2cc(C#N)nn2)ccc(Cl)c1F.CC(C)c1c(-n2cc(C(F)(F)F)nn2)ccc(Cl)c1F.CC(C)c1c(-n2cc(C3CC3)nn2)ccc(Cl)c1F.CC(C)c1c(-n2cc(Cl)nn2)ccc(Cl)c1F.CC(C)c1c(-n2ccnn2)ccc(Cl)c1F.CC(C)c1cc(Cl)ccc1-n1cc(C#N)nn1.CC(C)c1cc(Cl)ccc1-n1cc(C(F)(F)F)nn1.CC(C)c1cc(Cl)ccc1-n1cc(C2CC2)nn1.CC(C)c1cc(Cl)ccc1-n1cc(Cl)nn1.CC(C)c1cc(Cl)ccc1-n1ccnn1.Cc1cn(-c2ccc(Cl)c(F)c2C(C)C)nn1.Cc1cn(-c2ccc(Cl)c(F)c2C(C)C)nn1.Cc1cn(-c2ccc(Cl)cc2C(C)C)nn1.Cc1cn(-c2ccc(Cl)cc2C(C)C)nn1
InChIInChI=1S/C17H15ClFN3.C14H15ClFN3.C14H16ClN3.C12H10ClF4N3.C12H11ClF3N3.C12H10ClFN4.2C12H13ClFN3.C12H11ClN4.2C12H14ClN3.C11H10Cl2FN3.C11H11Cl2N3.C11H11ClFN3.C11H12ClN3/c1-11(2)16-15(9-8-13(18)17(16)19)22-10-14(20-21-22)12-6-4-3-5-7-12;1-8(2)13-12(6-5-10(15)14(13)16)19-7-11(17-18-19)9-3-4-9;1-9(2)12-7-11(15)5-6-14(12)18-8-13(16-17-18)10-3-4-10;1-6(2)10-8(4-3-7(13)11(10)14)20-5-9(18-19-20)12(15,16)17;1-7(2)9-5-8(13)3-4-10(9)19-6-11(17-18-19)12(14,15)16;1-7(2)11-10(4-3-9(13)12(11)14)18-6-8(5-15)16-17-18;2*1-7(2)11-10(5-4-9(13)12(11)14)17-6-8(3)15-16-17;1-8(2)11-5-9(13)3-4-12(11)17-7-10(6-14)15-16-17;2*1-8(2)11-6-10(13)4-5-12(11)16-7-9(3)14-15-16;1-6(2)10-8(4-3-7(12)11(10)14)17-5-9(13)15-16-17;1-7(2)9-5-8(12)3-4-10(9)16-6-11(13)14-15-16;1-7(2)10-9(16-6-5-14-15-16)4-3-8(12)11(10)13;1-8(2)10-7-9(12)3-4-11(10)15-6-5-13-14-15/h3-11H,1-2H3;5-9H,3-4H2,1-2H3;5-10H,3-4H2,1-2H3;3-6H,1-2H3;3-7H,1-2H3;3-4,6-7H,1-2H3;2*4-7H,1-3H3;3-5,7-8H,1-2H3;2*4-8H,1-3H3;3-6H,1-2H3;2*3-7H,1-2H3;3-8H,1-2H3
InChIKeyRWQFTFKFJZJYOF-UHFFFAOYSA-N
MW3936.52 g/mol
LogP54.52
Rot. Bonds33

About 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)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

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)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 (PubChem CID 160749559) has the molecular formula C185H186Cl17F14N47 and a molecular weight of 3936.52 g/mol. Its IUPAC name is 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)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.

Molecular Properties

Compound Name4-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)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
PubChem CID160749559
Molecular FormulaC185H186Cl17F14N47
Molecular Weight3936.52 g/mol
Exact Mass3926.05
IUPAC Name4-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)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
SMILESCC(C)c1c(-n2cc(-c3ccccc3)nn2)ccc(Cl)c1F.CC(C)c1c(-n2cc(C#N)nn2)ccc(Cl)c1F.CC(C)c1c(-n2cc(C(F)(F)F)nn2)ccc(Cl)c1F.CC(C)c1c(-n2cc(C3CC3)nn2)ccc(Cl)c1F.CC(C)c1c(-n2cc(Cl)nn2)ccc(Cl)c1F.CC(C)c1c(-n2ccnn2)ccc(Cl)c1F.CC(C)c1cc(Cl)ccc1-n1cc(C#N)nn1.CC(C)c1cc(Cl)ccc1-n1cc(C(F)(F)F)nn1.CC(C)c1cc(Cl)ccc1-n1cc(C2CC2)nn1.CC(C)c1cc(Cl)ccc1-n1cc(Cl)nn1.CC(C)c1cc(Cl)ccc1-n1ccnn1.Cc1cn(-c2ccc(Cl)c(F)c2C(C)C)nn1.Cc1cn(-c2ccc(Cl)c(F)c2C(C)C)nn1.Cc1cn(-c2ccc(Cl)cc2C(C)C)nn1.Cc1cn(-c2ccc(Cl)cc2C(C)C)nn1
InChIInChI=1S/C17H15ClFN3.C14H15ClFN3.C14H16ClN3.C12H10ClF4N3.C12H11ClF3N3.C12H10ClFN4.2C12H13ClFN3.C12H11ClN4.2C12H14ClN3.C11H10Cl2FN3.C11H11Cl2N3.C11H11ClFN3.C11H12ClN3/c1-11(2)16-15(9-8-13(18)17(16)19)22-10-14(20-21-22)12-6-4-3-5-7-12;1-8(2)13-12(6-5-10(15)14(13)16)19-7-11(17-18-19)9-3-4-9;1-9(2)12-7-11(15)5-6-14(12)18-8-13(16-17-18)10-3-4-10;1-6(2)10-8(4-3-7(13)11(10)14)20-5-9(18-19-20)12(15,16)17;1-7(2)9-5-8(13)3-4-10(9)19-6-11(17-18-19)12(14,15)16;1-7(2)11-10(4-3-9(13)12(11)14)18-6-8(5-15)16-17-18;2*1-7(2)11-10(5-4-9(13)12(11)14)17-6-8(3)15-16-17;1-8(2)11-5-9(13)3-4-12(11)17-7-10(6-14)15-16-17;2*1-8(2)11-6-10(13)4-5-12(11)16-7-9(3)14-15-16;1-6(2)10-8(4-3-7(12)11(10)14)17-5-9(13)15-16-17;1-7(2)9-5-8(12)3-4-10(9)16-6-11(13)14-15-16;1-7(2)10-9(16-6-5-14-15-16)4-3-8(12)11(10)13;1-8(2)10-7-9(12)3-4-11(10)15-6-5-13-14-15/h3-11H,1-2H3;5-9H,3-4H2,1-2H3;5-10H,3-4H2,1-2H3;3-6H,1-2H3;3-7H,1-2H3;3-4,6-7H,1-2H3;2*4-7H,1-3H3;3-5,7-8H,1-2H3;2*4-8H,1-3H3;3-6H,1-2H3;2*3-7H,1-2H3;3-8H,1-2H3
InChIKeyRWQFTFKFJZJYOF-UHFFFAOYSA-N
XLogP54.52
TPSA508.23 Ų
H-Bond Donors
H-Bond Acceptors47
Rotatable Bonds33
Heavy Atoms263
Complexity—

Lipinski Rule of Five

3 violations

RuleValue
MW ≤ 5003936.52
LogP ≤ 554.52
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 1047

Analyze 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)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 with MolForge

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Related Compounds

1-[4-Chloro-2-[1-[5-chloro-3-[1-[5-chloro-3-propan-2-yl-2-[4-(trifluoromethyl)triazol-1-yl]phenyl]propan-2-yl]-4-fluoro-2-[4-(trifluoromethyl)triazol-1-yl]phenyl]propan-2-yl]phenyl]triazole-4-carbonitrile
CID 126757786
1-[4-Chloro-2-[2-[3-chloro-5-[2-[5-chloro-2-(4-methyltriazol-1-yl)phenyl]propyl]-2-fluoro-6-(4-phenyltriazol-1-yl)phenyl]propyl]-6-propan-2-ylphenyl]-4-phenyltriazole
CID 134535104
1-[4-Chloro-6-[2-[5-chloro-2-(4-chlorotriazol-1-yl)phenyl]propyl]-2-[1-[5-chloro-2-(4-cyanotriazol-1-yl)-3-propan-2-ylphenyl]propan-2-yl]-3-fluorophenyl]triazole-4-carbonitrile
CID 135200522
1-[4-Chloro-2-[1-[5-chloro-3-[1-[5-chloro-2-(4-cyclopropyltriazol-1-yl)-4-fluoro-3-propan-2-ylphenyl]propan-2-yl]-2-[4-(trifluoromethyl)triazol-1-yl]phenyl]propan-2-yl]-3-fluorophenyl]-4-(trifluoromethyl)triazole
CID 135200523
1-[4-Chloro-2-[1-[5-chloro-3-[1-[5-chloro-4-fluoro-3-propan-2-yl-2-[4-(trifluoromethyl)triazol-1-yl]phenyl]propan-2-yl]-2-(4-cyanotriazol-1-yl)phenyl]propan-2-yl]-3-fluorophenyl]triazole-4-carbonitrile
CID 146396616
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)-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)-4-phenyltriazole;1-(4-chloro-2-propan-2-ylphenyl)triazole-4-carbonitrile;1-(4-chloro-2-propan-2-ylphenyl)-4-(trifluoromethyl)triazole
CID 157307534
4-Bromo-1-(4-chloro-3-fluoro-2-propan-2-ylphenyl)triazole;4-bromo-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)triazole-4-carboxamide;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)-4-phenyltriazole;1-(4-chloro-2-propan-2-ylphenyl)-4-(trifluoromethyl)triazole
CID 157864452
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)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-4-carbonitrile;1-(4-chloro-2-propan-2-ylphenyl)-4-(trifluoromethyl)triazole;methane
CID 157916895
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

Frequently Asked Questions

What is the IUPAC name of 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)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?
The IUPAC name of 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)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 160749559) is 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)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.
What is the SMILES notation for 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)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?
The canonical SMILES for 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)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 is CC(C)c1c(-n2cc(-c3ccccc3)nn2)ccc(Cl)c1F.CC(C)c1c(-n2cc(C#N)nn2)ccc(Cl)c1F.CC(C)c1c(-n2cc(C(F)(F)F)nn2)ccc(Cl)c1F.CC(C)c1c(-n2cc(C3CC3)nn2)ccc(Cl)c1F.CC(C)c1c(-n2cc(Cl)nn2)ccc(Cl)c1F.CC(C)c1c(-n2ccnn2)ccc(Cl)c1F.CC(C)c1cc(Cl)ccc1-n1cc(C#N)nn1.CC(C)c1cc(Cl)ccc1-n1cc(C(F)(F)F)nn1.CC(C)c1cc(Cl)ccc1-n1cc(C2CC2)nn1.CC(C)c1cc(Cl)ccc1-n1cc(Cl)nn1.CC(C)c1cc(Cl)ccc1-n1ccnn1.Cc1cn(-c2ccc(Cl)c(F)c2C(C)C)nn1.Cc1cn(-c2ccc(Cl)c(F)c2C(C)C)nn1.Cc1cn(-c2ccc(Cl)cc2C(C)C)nn1.Cc1cn(-c2ccc(Cl)cc2C(C)C)nn1.
What is the InChIKey of 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)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?
The InChIKey is RWQFTFKFJZJYOF-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H15ClFN3.C14H15ClFN3.C14H16ClN3.C12H10ClF4N3.C12H11ClF3N3.C12H10ClFN4.2C12H13ClFN3.C12H11ClN4.2C12H14ClN3.C11H10Cl2FN3.C11H11Cl2N3.C11H11ClFN3.C11H12ClN3/c1-11(2)16-15(9-8-13(18)17(16)19)22-10-14(20-21-22)12-6-4-3-5-7-12;1-8(2)13-12(6-5-10(15)14(13)16)19-7-11(17-18-19)9-3-4-9;1-9(2)12-7-11(15)5-6-14(12)18-8-13(16-17-18)10-3-4-10;1-6(2)10-8(4-3-7(13)11(10)14)20-5-9(18-19-20)12(15,16)17;1-7(2)9-5-8(13)3-4-10(9)19-6-11(17-18-19)12(14,15)16;1-7(2)11-10(4-3-9(13)12(11)14)18-6-8(5-15)16-17-18;2*1-7(2)11-10(5-4-9(13)12(11)14)17-6-8(3)15-16-17;1-8(2)11-5-9(13)3-4-12(11)17-7-10(6-14)15-16-17;2*1-8(2)11-6-10(13)4-5-12(11)16-7-9(3)14-15-16;1-6(2)10-8(4-3-7(12)11(10)14)17-5-9(13)15-16-17;1-7(2)9-5-8(12)3-4-10(9)16-6-11(13)14-15-16;1-7(2)10-9(16-6-5-14-15-16)4-3-8(12)11(10)13;1-8(2)10-7-9(12)3-4-11(10)15-6-5-13-14-15/h3-11H,1-2H3;5-9H,3-4H2,1-2H3;5-10H,3-4H2,1-2H3;3-6H,1-2H3;3-7H,1-2H3;3-4,6-7H,1-2H3;2*4-7H,1-3H3;3-5,7-8H,1-2H3;2*4-8H,1-3H3;3-6H,1-2H3;2*3-7H,1-2H3;3-8H,1-2H3.
What are the key properties of 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)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?
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)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 has a molecular weight of 3936.52 g/mol, XLogP of 54.52, 33 rotatable bonds, 0 hydrogen bond donors, and 47 hydrogen bond acceptors.
Where does this data come from?
All data for 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)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 is sourced from PubChem (CID 160749559), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).