2-(4-chloro-3-fluorophenyl)-1-(2-methylphenyl)ethanol

C15H14ClFO — CID 114012545

IUPAC2-(4-chloro-3-fluorophenyl)-1-(2-methylphenyl)ethanol
SMILESCc1ccccc1C(O)Cc1ccc(Cl)c(F)c1
InChIInChI=1S/C15H14ClFO/c1-10-4-2-3-5-12(10)15(18)9-11-6-7-13(16)14(17)8-11/h2-8,15,18H,9H2,1H3
InChIKeyNXVXTQXZKRTBJG-UHFFFAOYSA-N
MW264.73 g/mol
LogP4.06
Rot. Bonds3

About 2-(4-chloro-3-fluorophenyl)-1-(2-methylphenyl)ethanol

2-(4-chloro-3-fluorophenyl)-1-(2-methylphenyl)ethanol (PubChem CID 114012545) has the molecular formula C15H14ClFO and a molecular weight of 264.73 g/mol. Its IUPAC name is 2-(4-chloro-3-fluorophenyl)-1-(2-methylphenyl)ethanol.

Molecular Properties

Compound Name2-(4-chloro-3-fluorophenyl)-1-(2-methylphenyl)ethanol
PubChem CID114012545
Molecular FormulaC15H14ClFO
Molecular Weight264.73 g/mol
Exact Mass264.07
IUPAC Name2-(4-chloro-3-fluorophenyl)-1-(2-methylphenyl)ethanol
SMILESCc1ccccc1C(O)Cc1ccc(Cl)c(F)c1
InChIInChI=1S/C15H14ClFO/c1-10-4-2-3-5-12(10)15(18)9-11-6-7-13(16)14(17)8-11/h2-8,15,18H,9H2,1H3
InChIKeyNXVXTQXZKRTBJG-UHFFFAOYSA-N
XLogP4.06
TPSA20.23 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds3
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500264.73
LogP ≤ 54.06
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

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Related Compounds

2-(4-chloro-3-fluorophenyl)-1-(2-chlorophenyl)ethanol
CID 107883504
2-(4-chloro-3-fluorophenyl)-1-(4-fluoro-2-methylphenyl)ethanol
CID 107883556
2-(4-chloro-3-fluorophenyl)-1-(4-methyl-3-pyridinyl)ethanol
CID 114012571
2-(4-chloro-3-fluorophenyl)-1-(3-methyl-4-pyridinyl)ethanol
CID 107884336
2-(4-chloro-3-fluorophenyl)-1-(2,3-dichlorophenyl)ethanol
CID 107883512
1-(2-chloro-3-fluorophenyl)-2-(4-chloro-3-fluorophenyl)ethanol
CID 107894454
2-(4-chloro-3-fluorophenyl)-1-(2,4,6-trimethylphenyl)ethanol
CID 107883521
2-(4-chloro-3-fluorophenyl)-1-(2-fluoro-3-methylphenyl)ethanamine
CID 107885313
(4-chloro-3-fluorophenyl)-(2-methylphenyl)methanol
CID 63895727
2-(4-chloro-3-fluorophenyl)-1-(2,6-difluorophenyl)ethanol
CID 107883519
1-(2-chloro-4,5-dimethylphenyl)-2-(3,4-difluorophenyl)ethanol
CID 115484531
1-(5-bromo-2-chlorophenyl)-2-(4-chloro-3-fluorophenyl)ethanol
CID 107894369

Frequently Asked Questions

What is the IUPAC name of 2-(4-chloro-3-fluorophenyl)-1-(2-methylphenyl)ethanol?
The IUPAC name of 2-(4-chloro-3-fluorophenyl)-1-(2-methylphenyl)ethanol (CID 114012545) is 2-(4-chloro-3-fluorophenyl)-1-(2-methylphenyl)ethanol.
What is the SMILES notation for 2-(4-chloro-3-fluorophenyl)-1-(2-methylphenyl)ethanol?
The canonical SMILES for 2-(4-chloro-3-fluorophenyl)-1-(2-methylphenyl)ethanol is Cc1ccccc1C(O)Cc1ccc(Cl)c(F)c1.
What is the InChIKey of 2-(4-chloro-3-fluorophenyl)-1-(2-methylphenyl)ethanol?
The InChIKey is NXVXTQXZKRTBJG-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H14ClFO/c1-10-4-2-3-5-12(10)15(18)9-11-6-7-13(16)14(17)8-11/h2-8,15,18H,9H2,1H3.
What are the key properties of 2-(4-chloro-3-fluorophenyl)-1-(2-methylphenyl)ethanol?
2-(4-chloro-3-fluorophenyl)-1-(2-methylphenyl)ethanol has a molecular weight of 264.73 g/mol, XLogP of 4.06, 3 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(4-chloro-3-fluorophenyl)-1-(2-methylphenyl)ethanol is sourced from PubChem (CID 114012545), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).