1-(5-chloro-2-methylphenyl)-2-(4-ethylphenyl)ethanol

C17H19ClO — CID 114980972

IUPAC1-(5-chloro-2-methylphenyl)-2-(4-ethylphenyl)ethanol
SMILESCCc1ccc(CC(O)c2cc(Cl)ccc2C)cc1
InChIInChI=1S/C17H19ClO/c1-3-13-5-7-14(8-6-13)10-17(19)16-11-15(18)9-4-12(16)2/h4-9,11,17,19H,3,10H2,1-2H3
InChIKeyAVPIDIUAIRRRGX-UHFFFAOYSA-N
MW274.79 g/mol
LogP4.49
Rot. Bonds4

About 1-(5-chloro-2-methylphenyl)-2-(4-ethylphenyl)ethanol

1-(5-chloro-2-methylphenyl)-2-(4-ethylphenyl)ethanol (PubChem CID 114980972) has the molecular formula C17H19ClO and a molecular weight of 274.79 g/mol. Its IUPAC name is 1-(5-chloro-2-methylphenyl)-2-(4-ethylphenyl)ethanol.

Molecular Properties

Compound Name1-(5-chloro-2-methylphenyl)-2-(4-ethylphenyl)ethanol
PubChem CID114980972
Molecular FormulaC17H19ClO
Molecular Weight274.79 g/mol
Exact Mass274.11
IUPAC Name1-(5-chloro-2-methylphenyl)-2-(4-ethylphenyl)ethanol
SMILESCCc1ccc(CC(O)c2cc(Cl)ccc2C)cc1
InChIInChI=1S/C17H19ClO/c1-3-13-5-7-14(8-6-13)10-17(19)16-11-15(18)9-4-12(16)2/h4-9,11,17,19H,3,10H2,1-2H3
InChIKeyAVPIDIUAIRRRGX-UHFFFAOYSA-N
XLogP4.49
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 ≤ 54.49
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

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Related Compounds

2-(4-chlorophenyl)-1-(2,4,5-trimethylphenyl)ethanol
CID 64989886
4-chloro-2-[chloro-(4-ethylphenyl)methyl]-1-methylbenzene
CID 82890709
1-(5-chloro-2-methylphenyl)-2-(furan-3-yl)ethanol
CID 115830406
1-(5-chloro-2-methylphenyl)decan-1-ol
CID 115783029
2-(2-chloro-4-methylphenyl)-1-(5-chloro-2-methylphenyl)ethanol
CID 106868133
2-(5-chloro-2-fluorophenyl)-1-(5-fluoro-2-methylphenyl)ethanol
CID 103048202
[(5-chloro-2-methylphenyl)-(4-ethylphenyl)methyl]hydrazine
CID 105292944
2-(3-chlorophenyl)-1-(5-fluoro-2-methylphenyl)ethanol
CID 62387586
2-(2-bromo-4-fluorophenyl)-1-(5-chloro-2-methylphenyl)ethanol
CID 115787001
1-(5-chloro-2-methylphenyl)-2-(4-chlorophenyl)-N-ethylethanamine
CID 82883080
2-(2,4-dichlorophenyl)-1-(5-fluoro-2-methylphenyl)ethanol
CID 62607142
2-(2-chloro-3-fluorophenyl)-1-(5-chloro-2-methylphenyl)ethanol
CID 115831225

Frequently Asked Questions

What is the IUPAC name of 1-(5-chloro-2-methylphenyl)-2-(4-ethylphenyl)ethanol?
The IUPAC name of 1-(5-chloro-2-methylphenyl)-2-(4-ethylphenyl)ethanol (CID 114980972) is 1-(5-chloro-2-methylphenyl)-2-(4-ethylphenyl)ethanol.
What is the SMILES notation for 1-(5-chloro-2-methylphenyl)-2-(4-ethylphenyl)ethanol?
The canonical SMILES for 1-(5-chloro-2-methylphenyl)-2-(4-ethylphenyl)ethanol is CCc1ccc(CC(O)c2cc(Cl)ccc2C)cc1.
What is the InChIKey of 1-(5-chloro-2-methylphenyl)-2-(4-ethylphenyl)ethanol?
The InChIKey is AVPIDIUAIRRRGX-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H19ClO/c1-3-13-5-7-14(8-6-13)10-17(19)16-11-15(18)9-4-12(16)2/h4-9,11,17,19H,3,10H2,1-2H3.
What are the key properties of 1-(5-chloro-2-methylphenyl)-2-(4-ethylphenyl)ethanol?
1-(5-chloro-2-methylphenyl)-2-(4-ethylphenyl)ethanol has a molecular weight of 274.79 g/mol, XLogP of 4.49, 4 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 1-(5-chloro-2-methylphenyl)-2-(4-ethylphenyl)ethanol is sourced from PubChem (CID 114980972), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).