1-(2-chloro-3-fluorophenyl)-2-phenylpropan-2-ol

C15H14ClFO — CID 112652939

IUPAC1-(2-chloro-3-fluorophenyl)-2-phenylpropan-2-ol
SMILESCC(O)(Cc1cccc(F)c1Cl)c1ccccc1
InChIInChI=1S/C15H14ClFO/c1-15(18,12-7-3-2-4-8-12)10-11-6-5-9-13(17)14(11)16/h2-9,18H,10H2,1H3
InChIKeyFYBOWFGKKRNIQV-UHFFFAOYSA-N
MW264.73 g/mol
LogP3.93
Rot. Bonds3

About 1-(2-chloro-3-fluorophenyl)-2-phenylpropan-2-ol

1-(2-chloro-3-fluorophenyl)-2-phenylpropan-2-ol (PubChem CID 112652939) has the molecular formula C15H14ClFO and a molecular weight of 264.73 g/mol. Its IUPAC name is 1-(2-chloro-3-fluorophenyl)-2-phenylpropan-2-ol.

Molecular Properties

Compound Name1-(2-chloro-3-fluorophenyl)-2-phenylpropan-2-ol
PubChem CID112652939
Molecular FormulaC15H14ClFO
Molecular Weight264.73 g/mol
Exact Mass264.07
IUPAC Name1-(2-chloro-3-fluorophenyl)-2-phenylpropan-2-ol
SMILESCC(O)(Cc1cccc(F)c1Cl)c1ccccc1
InChIInChI=1S/C15H14ClFO/c1-15(18,12-7-3-2-4-8-12)10-11-6-5-9-13(17)14(11)16/h2-9,18H,10H2,1H3
InChIKeyFYBOWFGKKRNIQV-UHFFFAOYSA-N
XLogP3.93
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 ≤ 53.93
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

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Related Compounds

1-(2-chloro-3-fluorophenyl)-2-(4-chlorophenyl)propan-2-ol
CID 112652946
1-(2-chloro-3-fluorophenyl)-2-(3-chlorophenyl)propan-2-ol
CID 112652947
2-(4-bromophenyl)-1-(2-chloro-3-fluorophenyl)propan-2-ol
CID 112652949
1-(2-chloro-3-fluorophenyl)-2-(furan-3-yl)propan-2-ol
CID 112653159
1-(2-chloro-3-fluorophenyl)-2-phenylpentan-2-ol
CID 115983354
1-(2-chloro-3-fluorophenyl)-2-thiophen-2-ylpropan-2-ol
CID 112652973
1-(2,6-difluorophenyl)-2-phenylpropan-2-ol
CID 114930959
4-(2-chloro-3-fluorophenyl)-3-hydroxy-3-methylbutanal
CID 112653106
2-[(2-chloro-3-fluorophenyl)methyl]-2-phenylbutanoic acid
CID 115983256
1-(2,3-dichlorophenyl)-3-(2-fluorophenyl)-2-methylpropan-2-ol
CID 107307675
1-(2-chloro-3-fluorophenyl)-2-methylheptan-2-ol
CID 112653134
1-(2-chloro-3-fluorophenyl)-6,6,6-trifluoro-2-methylhexan-2-ol
CID 116535931

Frequently Asked Questions

What is the IUPAC name of 1-(2-chloro-3-fluorophenyl)-2-phenylpropan-2-ol?
The IUPAC name of 1-(2-chloro-3-fluorophenyl)-2-phenylpropan-2-ol (CID 112652939) is 1-(2-chloro-3-fluorophenyl)-2-phenylpropan-2-ol.
What is the SMILES notation for 1-(2-chloro-3-fluorophenyl)-2-phenylpropan-2-ol?
The canonical SMILES for 1-(2-chloro-3-fluorophenyl)-2-phenylpropan-2-ol is CC(O)(Cc1cccc(F)c1Cl)c1ccccc1.
What is the InChIKey of 1-(2-chloro-3-fluorophenyl)-2-phenylpropan-2-ol?
The InChIKey is FYBOWFGKKRNIQV-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H14ClFO/c1-15(18,12-7-3-2-4-8-12)10-11-6-5-9-13(17)14(11)16/h2-9,18H,10H2,1H3.
What are the key properties of 1-(2-chloro-3-fluorophenyl)-2-phenylpropan-2-ol?
1-(2-chloro-3-fluorophenyl)-2-phenylpropan-2-ol has a molecular weight of 264.73 g/mol, XLogP of 3.93, 3 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 1-(2-chloro-3-fluorophenyl)-2-phenylpropan-2-ol is sourced from PubChem (CID 112652939), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).