4-chloro-2-(3-methoxyphenyl)-1-propan-2-ylbenzene;4-chloro-2-(4-methoxyphenyl)-1-propan-2-ylbenzene;1-fluoro-3-(4-propan-2-ylphenyl)benzene;[4-(5-fluoro-2-propan-2-ylphenyl)phenyl]methanol;1-methoxy-3-(3-propan-2-ylphenyl)benzene;1-methoxy-3-(4-propan-2-ylphenyl)benzene;1-phenyl-4-propan-2-ylbenzene;4-(4-propan-2-ylphenyl)phenol;1-propan-2-yl-4-[3-(2,2,2-trifluoroethoxy)phenyl]benzene

C142H151Cl2F5O7 — CID 159434818

IUPAC4-chloro-2-(3-methoxyphenyl)-1-propan-2-ylbenzene;4-chloro-2-(4-methoxyphenyl)-1-propan-2-ylbenzene;1-fluoro-3-(4-propan-2-ylphenyl)benzene;[4-(5-fluoro-2-propan-2-ylphenyl)phenyl]methanol;1-methoxy-3-(3-propan-2-ylphenyl)benzene;1-methoxy-3-(4-propan-2-ylphenyl)benzene;1-phenyl-4-propan-2-ylbenzene;4-(4-propan-2-ylphenyl)phenol;1-propan-2-yl-4-[3-(2,2,2-trifluoroethoxy)phenyl]benzene
SMILESCC(C)c1ccc(-c2ccc(O)cc2)cc1.CC(C)c1ccc(-c2cccc(F)c2)cc1.CC(C)c1ccc(-c2cccc(OCC(F)(F)F)c2)cc1.CC(C)c1ccc(-c2ccccc2)cc1.CC(C)c1ccc(F)cc1-c1ccc(CO)cc1.COc1ccc(-c2cc(Cl)ccc2C(C)C)cc1.COc1cccc(-c2cc(Cl)ccc2C(C)C)c1.COc1cccc(-c2ccc(C(C)C)cc2)c1.COc1cccc(-c2cccc(C(C)C)c2)c1
InChIInChI=1S/C17H17F3O.2C16H17ClO.C16H17FO.2C16H18O.C15H15F.C15H16O.C15H16/c1-12(2)13-6-8-14(9-7-13)15-4-3-5-16(10-15)21-11-17(18,19)20;1-11(2)15-9-6-13(17)10-16(15)12-4-7-14(18-3)8-5-12;1-11(2)15-8-7-13(17)10-16(15)12-5-4-6-14(9-12)18-3;1-11(2)15-8-7-14(17)9-16(15)13-5-3-12(10-18)4-6-13;1-12(2)13-6-4-7-14(10-13)15-8-5-9-16(11-15)17-3;1-12(2)13-7-9-14(10-8-13)15-5-4-6-16(11-15)17-3;1-11(2)12-6-8-13(9-7-12)14-4-3-5-15(16)10-14;1-11(2)12-3-5-13(6-4-12)14-7-9-15(16)10-8-14;1-12(2)13-8-10-15(11-9-13)14-6-4-3-5-7-14/h3-10,12H,11H2,1-2H3;2*4-11H,1-3H3;3-9,11,18H,10H2,1-2H3;2*4-12H,1-3H3;3-11H,1-2H3;3-11,16H,1-2H3;3-12H,1-2H3
InChIKeyLRLFSUUJVBNVJB-UHFFFAOYSA-N
MW2135.66 g/mol
LogP42.05
Rot. Bonds25

About 4-chloro-2-(3-methoxyphenyl)-1-propan-2-ylbenzene;4-chloro-2-(4-methoxyphenyl)-1-propan-2-ylbenzene;1-fluoro-3-(4-propan-2-ylphenyl)benzene;[4-(5-fluoro-2-propan-2-ylphenyl)phenyl]methanol;1-methoxy-3-(3-propan-2-ylphenyl)benzene;1-methoxy-3-(4-propan-2-ylphenyl)benzene;1-phenyl-4-propan-2-ylbenzene;4-(4-propan-2-ylphenyl)phenol;1-propan-2-yl-4-[3-(2,2,2-trifluoroethoxy)phenyl]benzene

4-chloro-2-(3-methoxyphenyl)-1-propan-2-ylbenzene;4-chloro-2-(4-methoxyphenyl)-1-propan-2-ylbenzene;1-fluoro-3-(4-propan-2-ylphenyl)benzene;[4-(5-fluoro-2-propan-2-ylphenyl)phenyl]methanol;1-methoxy-3-(3-propan-2-ylphenyl)benzene;1-methoxy-3-(4-propan-2-ylphenyl)benzene;1-phenyl-4-propan-2-ylbenzene;4-(4-propan-2-ylphenyl)phenol;1-propan-2-yl-4-[3-(2,2,2-trifluoroethoxy)phenyl]benzene (PubChem CID 159434818) has the molecular formula C142H151Cl2F5O7 and a molecular weight of 2135.66 g/mol. Its IUPAC name is 4-chloro-2-(3-methoxyphenyl)-1-propan-2-ylbenzene;4-chloro-2-(4-methoxyphenyl)-1-propan-2-ylbenzene;1-fluoro-3-(4-propan-2-ylphenyl)benzene;[4-(5-fluoro-2-propan-2-ylphenyl)phenyl]methanol;1-methoxy-3-(3-propan-2-ylphenyl)benzene;1-methoxy-3-(4-propan-2-ylphenyl)benzene;1-phenyl-4-propan-2-ylbenzene;4-(4-propan-2-ylphenyl)phenol;1-propan-2-yl-4-[3-(2,2,2-trifluoroethoxy)phenyl]benzene.

Molecular Properties

Compound Name4-chloro-2-(3-methoxyphenyl)-1-propan-2-ylbenzene;4-chloro-2-(4-methoxyphenyl)-1-propan-2-ylbenzene;1-fluoro-3-(4-propan-2-ylphenyl)benzene;[4-(5-fluoro-2-propan-2-ylphenyl)phenyl]methanol;1-methoxy-3-(3-propan-2-ylphenyl)benzene;1-methoxy-3-(4-propan-2-ylphenyl)benzene;1-phenyl-4-propan-2-ylbenzene;4-(4-propan-2-ylphenyl)phenol;1-propan-2-yl-4-[3-(2,2,2-trifluoroethoxy)phenyl]benzene
PubChem CID159434818
Molecular FormulaC142H151Cl2F5O7
Molecular Weight2135.66 g/mol
Exact Mass2133.08
IUPAC Name4-chloro-2-(3-methoxyphenyl)-1-propan-2-ylbenzene;4-chloro-2-(4-methoxyphenyl)-1-propan-2-ylbenzene;1-fluoro-3-(4-propan-2-ylphenyl)benzene;[4-(5-fluoro-2-propan-2-ylphenyl)phenyl]methanol;1-methoxy-3-(3-propan-2-ylphenyl)benzene;1-methoxy-3-(4-propan-2-ylphenyl)benzene;1-phenyl-4-propan-2-ylbenzene;4-(4-propan-2-ylphenyl)phenol;1-propan-2-yl-4-[3-(2,2,2-trifluoroethoxy)phenyl]benzene
SMILESCC(C)c1ccc(-c2ccc(O)cc2)cc1.CC(C)c1ccc(-c2cccc(F)c2)cc1.CC(C)c1ccc(-c2cccc(OCC(F)(F)F)c2)cc1.CC(C)c1ccc(-c2ccccc2)cc1.CC(C)c1ccc(F)cc1-c1ccc(CO)cc1.COc1ccc(-c2cc(Cl)ccc2C(C)C)cc1.COc1cccc(-c2cc(Cl)ccc2C(C)C)c1.COc1cccc(-c2ccc(C(C)C)cc2)c1.COc1cccc(-c2cccc(C(C)C)c2)c1
InChIInChI=1S/C17H17F3O.2C16H17ClO.C16H17FO.2C16H18O.C15H15F.C15H16O.C15H16/c1-12(2)13-6-8-14(9-7-13)15-4-3-5-16(10-15)21-11-17(18,19)20;1-11(2)15-9-6-13(17)10-16(15)12-4-7-14(18-3)8-5-12;1-11(2)15-8-7-13(17)10-16(15)12-5-4-6-14(9-12)18-3;1-11(2)15-8-7-14(17)9-16(15)13-5-3-12(10-18)4-6-13;1-12(2)13-6-4-7-14(10-13)15-8-5-9-16(11-15)17-3;1-12(2)13-7-9-14(10-8-13)15-5-4-6-16(11-15)17-3;1-11(2)12-6-8-13(9-7-12)14-4-3-5-15(16)10-14;1-11(2)12-3-5-13(6-4-12)14-7-9-15(16)10-8-14;1-12(2)13-8-10-15(11-9-13)14-6-4-3-5-7-14/h3-10,12H,11H2,1-2H3;2*4-11H,1-3H3;3-9,11,18H,10H2,1-2H3;2*4-12H,1-3H3;3-11H,1-2H3;3-11,16H,1-2H3;3-12H,1-2H3
InChIKeyLRLFSUUJVBNVJB-UHFFFAOYSA-N
XLogP42.05
TPSA86.61 Ų
H-Bond Donors2
H-Bond Acceptors7
Rotatable Bonds25
Heavy Atoms156
Complexity—

Lipinski Rule of Five

2 violations

RuleValue
MW ≤ 5002135.66
LogP ≤ 542.05
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 107

Analyze 4-chloro-2-(3-methoxyphenyl)-1-propan-2-ylbenzene;4-chloro-2-(4-methoxyphenyl)-1-propan-2-ylbenzene;1-fluoro-3-(4-propan-2-ylphenyl)benzene;[4-(5-fluoro-2-propan-2-ylphenyl)phenyl]methanol;1-methoxy-3-(3-propan-2-ylphenyl)benzene;1-methoxy-3-(4-propan-2-ylphenyl)benzene;1-phenyl-4-propan-2-ylbenzene;4-(4-propan-2-ylphenyl)phenol;1-propan-2-yl-4-[3-(2,2,2-trifluoroethoxy)phenyl]benzene with MolForge

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Related Compounds

cumene;1-(methoxymethyl)-3-propan-2-ylbenzene;1-methoxy-4-propan-2-ylbenzene;(4-propan-2-ylphenyl)methanol
CID 157414153
2-(3-propan-2-ylphenyl)-5-(2,2,2-trifluoroethoxy)aniline
CID 172674959
1-methoxy-4-(3-propan-2-ylphenyl)benzene
CID 20871880
4-methoxy-2-phenyl-1-propan-2-ylbenzene
CID 118344819
1-methoxy-3-(3-propan-2-ylphenyl)benzene
CID 23110868
cumene;2,4-difluoro-1-propan-2-ylbenzene
CID 156717467
1-methoxy-2-propan-2-ylbenzene;1-methoxy-3-propan-2-ylbenzene;1-methoxy-4-propan-2-ylbenzene
CID 158244834
2-(2-fluoro-4-methoxyphenyl)-6-(2,2,2-trifluoroethoxy)naphthalene
CID 139856467
2-(5-chloro-2-propan-2-ylphenyl)naphthalene
CID 142314685
1-phenyl-4-(3-propan-2-ylphenyl)benzene;1-phenyl-4-(4-propan-2-ylphenyl)benzene
CID 160951739
2-chloro-1-(3-methoxyphenyl)-4-phenylbenzene
CID 173255261
2-chloro-1-fluoro-4-(3-methoxyphenyl)benzene
CID 91071120

Frequently Asked Questions

What is the IUPAC name of 4-chloro-2-(3-methoxyphenyl)-1-propan-2-ylbenzene;4-chloro-2-(4-methoxyphenyl)-1-propan-2-ylbenzene;1-fluoro-3-(4-propan-2-ylphenyl)benzene;[4-(5-fluoro-2-propan-2-ylphenyl)phenyl]methanol;1-methoxy-3-(3-propan-2-ylphenyl)benzene;1-methoxy-3-(4-propan-2-ylphenyl)benzene;1-phenyl-4-propan-2-ylbenzene;4-(4-propan-2-ylphenyl)phenol;1-propan-2-yl-4-[3-(2,2,2-trifluoroethoxy)phenyl]benzene?
The IUPAC name of 4-chloro-2-(3-methoxyphenyl)-1-propan-2-ylbenzene;4-chloro-2-(4-methoxyphenyl)-1-propan-2-ylbenzene;1-fluoro-3-(4-propan-2-ylphenyl)benzene;[4-(5-fluoro-2-propan-2-ylphenyl)phenyl]methanol;1-methoxy-3-(3-propan-2-ylphenyl)benzene;1-methoxy-3-(4-propan-2-ylphenyl)benzene;1-phenyl-4-propan-2-ylbenzene;4-(4-propan-2-ylphenyl)phenol;1-propan-2-yl-4-[3-(2,2,2-trifluoroethoxy)phenyl]benzene (CID 159434818) is 4-chloro-2-(3-methoxyphenyl)-1-propan-2-ylbenzene;4-chloro-2-(4-methoxyphenyl)-1-propan-2-ylbenzene;1-fluoro-3-(4-propan-2-ylphenyl)benzene;[4-(5-fluoro-2-propan-2-ylphenyl)phenyl]methanol;1-methoxy-3-(3-propan-2-ylphenyl)benzene;1-methoxy-3-(4-propan-2-ylphenyl)benzene;1-phenyl-4-propan-2-ylbenzene;4-(4-propan-2-ylphenyl)phenol;1-propan-2-yl-4-[3-(2,2,2-trifluoroethoxy)phenyl]benzene.
What is the SMILES notation for 4-chloro-2-(3-methoxyphenyl)-1-propan-2-ylbenzene;4-chloro-2-(4-methoxyphenyl)-1-propan-2-ylbenzene;1-fluoro-3-(4-propan-2-ylphenyl)benzene;[4-(5-fluoro-2-propan-2-ylphenyl)phenyl]methanol;1-methoxy-3-(3-propan-2-ylphenyl)benzene;1-methoxy-3-(4-propan-2-ylphenyl)benzene;1-phenyl-4-propan-2-ylbenzene;4-(4-propan-2-ylphenyl)phenol;1-propan-2-yl-4-[3-(2,2,2-trifluoroethoxy)phenyl]benzene?
The canonical SMILES for 4-chloro-2-(3-methoxyphenyl)-1-propan-2-ylbenzene;4-chloro-2-(4-methoxyphenyl)-1-propan-2-ylbenzene;1-fluoro-3-(4-propan-2-ylphenyl)benzene;[4-(5-fluoro-2-propan-2-ylphenyl)phenyl]methanol;1-methoxy-3-(3-propan-2-ylphenyl)benzene;1-methoxy-3-(4-propan-2-ylphenyl)benzene;1-phenyl-4-propan-2-ylbenzene;4-(4-propan-2-ylphenyl)phenol;1-propan-2-yl-4-[3-(2,2,2-trifluoroethoxy)phenyl]benzene is CC(C)c1ccc(-c2ccc(O)cc2)cc1.CC(C)c1ccc(-c2cccc(F)c2)cc1.CC(C)c1ccc(-c2cccc(OCC(F)(F)F)c2)cc1.CC(C)c1ccc(-c2ccccc2)cc1.CC(C)c1ccc(F)cc1-c1ccc(CO)cc1.COc1ccc(-c2cc(Cl)ccc2C(C)C)cc1.COc1cccc(-c2cc(Cl)ccc2C(C)C)c1.COc1cccc(-c2ccc(C(C)C)cc2)c1.COc1cccc(-c2cccc(C(C)C)c2)c1.
What is the InChIKey of 4-chloro-2-(3-methoxyphenyl)-1-propan-2-ylbenzene;4-chloro-2-(4-methoxyphenyl)-1-propan-2-ylbenzene;1-fluoro-3-(4-propan-2-ylphenyl)benzene;[4-(5-fluoro-2-propan-2-ylphenyl)phenyl]methanol;1-methoxy-3-(3-propan-2-ylphenyl)benzene;1-methoxy-3-(4-propan-2-ylphenyl)benzene;1-phenyl-4-propan-2-ylbenzene;4-(4-propan-2-ylphenyl)phenol;1-propan-2-yl-4-[3-(2,2,2-trifluoroethoxy)phenyl]benzene?
The InChIKey is LRLFSUUJVBNVJB-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H17F3O.2C16H17ClO.C16H17FO.2C16H18O.C15H15F.C15H16O.C15H16/c1-12(2)13-6-8-14(9-7-13)15-4-3-5-16(10-15)21-11-17(18,19)20;1-11(2)15-9-6-13(17)10-16(15)12-4-7-14(18-3)8-5-12;1-11(2)15-8-7-13(17)10-16(15)12-5-4-6-14(9-12)18-3;1-11(2)15-8-7-14(17)9-16(15)13-5-3-12(10-18)4-6-13;1-12(2)13-6-4-7-14(10-13)15-8-5-9-16(11-15)17-3;1-12(2)13-7-9-14(10-8-13)15-5-4-6-16(11-15)17-3;1-11(2)12-6-8-13(9-7-12)14-4-3-5-15(16)10-14;1-11(2)12-3-5-13(6-4-12)14-7-9-15(16)10-8-14;1-12(2)13-8-10-15(11-9-13)14-6-4-3-5-7-14/h3-10,12H,11H2,1-2H3;2*4-11H,1-3H3;3-9,11,18H,10H2,1-2H3;2*4-12H,1-3H3;3-11H,1-2H3;3-11,16H,1-2H3;3-12H,1-2H3.
What are the key properties of 4-chloro-2-(3-methoxyphenyl)-1-propan-2-ylbenzene;4-chloro-2-(4-methoxyphenyl)-1-propan-2-ylbenzene;1-fluoro-3-(4-propan-2-ylphenyl)benzene;[4-(5-fluoro-2-propan-2-ylphenyl)phenyl]methanol;1-methoxy-3-(3-propan-2-ylphenyl)benzene;1-methoxy-3-(4-propan-2-ylphenyl)benzene;1-phenyl-4-propan-2-ylbenzene;4-(4-propan-2-ylphenyl)phenol;1-propan-2-yl-4-[3-(2,2,2-trifluoroethoxy)phenyl]benzene?
4-chloro-2-(3-methoxyphenyl)-1-propan-2-ylbenzene;4-chloro-2-(4-methoxyphenyl)-1-propan-2-ylbenzene;1-fluoro-3-(4-propan-2-ylphenyl)benzene;[4-(5-fluoro-2-propan-2-ylphenyl)phenyl]methanol;1-methoxy-3-(3-propan-2-ylphenyl)benzene;1-methoxy-3-(4-propan-2-ylphenyl)benzene;1-phenyl-4-propan-2-ylbenzene;4-(4-propan-2-ylphenyl)phenol;1-propan-2-yl-4-[3-(2,2,2-trifluoroethoxy)phenyl]benzene has a molecular weight of 2135.66 g/mol, XLogP of 42.05, 25 rotatable bonds, 2 hydrogen bond donors, and 7 hydrogen bond acceptors.
Where does this data come from?
All data for 4-chloro-2-(3-methoxyphenyl)-1-propan-2-ylbenzene;4-chloro-2-(4-methoxyphenyl)-1-propan-2-ylbenzene;1-fluoro-3-(4-propan-2-ylphenyl)benzene;[4-(5-fluoro-2-propan-2-ylphenyl)phenyl]methanol;1-methoxy-3-(3-propan-2-ylphenyl)benzene;1-methoxy-3-(4-propan-2-ylphenyl)benzene;1-phenyl-4-propan-2-ylbenzene;4-(4-propan-2-ylphenyl)phenol;1-propan-2-yl-4-[3-(2,2,2-trifluoroethoxy)phenyl]benzene is sourced from PubChem (CID 159434818), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).