1-(2-chlorophenyl)-1-(3-propylphenyl)ethanol

C17H19ClO — CID 116542288

IUPAC1-(2-chlorophenyl)-1-(3-propylphenyl)ethanol
SMILESCCCc1cccc(C(C)(O)c2ccccc2Cl)c1
InChIInChI=1S/C17H19ClO/c1-3-7-13-8-6-9-14(12-13)17(2,19)15-10-4-5-11-16(15)18/h4-6,8-12,19H,3,7H2,1-2H3
InChIKeyHLCCJJPIKYRPSV-UHFFFAOYSA-N
MW274.79 g/mol
LogP4.55
Rot. Bonds4

About 1-(2-chlorophenyl)-1-(3-propylphenyl)ethanol

1-(2-chlorophenyl)-1-(3-propylphenyl)ethanol (PubChem CID 116542288) has the molecular formula C17H19ClO and a molecular weight of 274.79 g/mol. Its IUPAC name is 1-(2-chlorophenyl)-1-(3-propylphenyl)ethanol.

Molecular Properties

Compound Name1-(2-chlorophenyl)-1-(3-propylphenyl)ethanol
PubChem CID116542288
Molecular FormulaC17H19ClO
Molecular Weight274.79 g/mol
Exact Mass274.11
IUPAC Name1-(2-chlorophenyl)-1-(3-propylphenyl)ethanol
SMILESCCCc1cccc(C(C)(O)c2ccccc2Cl)c1
InChIInChI=1S/C17H19ClO/c1-3-7-13-8-6-9-14(12-13)17(2,19)15-10-4-5-11-16(15)18/h4-6,8-12,19H,3,7H2,1-2H3
InChIKeyHLCCJJPIKYRPSV-UHFFFAOYSA-N
XLogP4.55
TPSA20.23 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds4
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500274.79
LogP ≤ 54.55
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

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Related Compounds

3-(3-propylphenyl)pentan-3-ol
CID 116542305
1-(3,5-dimethylphenyl)-1-(3-propylphenyl)ethanol
CID 116542790
1-(4-fluorophenyl)-1-(3-propylphenyl)ethanol
CID 116542276
2-(2-chlorophenyl)-1-[3-(trifluoromethyl)phenyl]propan-2-ol
CID 65145336
3-[1-hydroxy-1-(3-propylphenyl)ethyl]benzonitrile
CID 116542774
1-(3-methylthiophen-2-yl)-1-(3-propylphenyl)ethanol
CID 116542561
1,1,1,3,3,3-hexafluoro-2-(3-propylphenyl)propan-2-ol
CID 20728974
1-(2-methylsulfanylpropan-2-yl)-3-propylbenzene
CID 91471137
1-(2-chlorophenyl)-1-[4-(trifluoromethyl)phenyl]ethanol
CID 62788125
1-tert-butyl-3-(2,2-dimethylpropyl)benzene;1-(2,2-dimethylpropyl)-3-propylbenzene
CID 145400173
1-(2-fluoro-6-methoxyphenyl)-1-(3-propylphenyl)ethanol
CID 116542850
4,5,5,5-tetrafluoro-2-(3-propylphenyl)-4-(trifluoromethyl)pentan-2-ol
CID 156764819

Frequently Asked Questions

What is the IUPAC name of 1-(2-chlorophenyl)-1-(3-propylphenyl)ethanol?
The IUPAC name of 1-(2-chlorophenyl)-1-(3-propylphenyl)ethanol (CID 116542288) is 1-(2-chlorophenyl)-1-(3-propylphenyl)ethanol.
What is the SMILES notation for 1-(2-chlorophenyl)-1-(3-propylphenyl)ethanol?
The canonical SMILES for 1-(2-chlorophenyl)-1-(3-propylphenyl)ethanol is CCCc1cccc(C(C)(O)c2ccccc2Cl)c1.
What is the InChIKey of 1-(2-chlorophenyl)-1-(3-propylphenyl)ethanol?
The InChIKey is HLCCJJPIKYRPSV-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H19ClO/c1-3-7-13-8-6-9-14(12-13)17(2,19)15-10-4-5-11-16(15)18/h4-6,8-12,19H,3,7H2,1-2H3.
What are the key properties of 1-(2-chlorophenyl)-1-(3-propylphenyl)ethanol?
1-(2-chlorophenyl)-1-(3-propylphenyl)ethanol has a molecular weight of 274.79 g/mol, XLogP of 4.55, 4 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 1-(2-chlorophenyl)-1-(3-propylphenyl)ethanol is sourced from PubChem (CID 116542288), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).