2-(3,4-difluorophenyl)-1-(2-fluorophenyl)propan-2-ol

C15H13F3O — CID 114832741

IUPAC2-(3,4-difluorophenyl)-1-(2-fluorophenyl)propan-2-ol
SMILESCC(O)(Cc1ccccc1F)c1ccc(F)c(F)c1
InChIInChI=1S/C15H13F3O/c1-15(19,9-10-4-2-3-5-12(10)16)11-6-7-13(17)14(18)8-11/h2-8,19H,9H2,1H3
InChIKeyWTJNSRHCWHWXCN-UHFFFAOYSA-N
MW266.26 g/mol
LogP3.55
Rot. Bonds3

About 2-(3,4-difluorophenyl)-1-(2-fluorophenyl)propan-2-ol

2-(3,4-difluorophenyl)-1-(2-fluorophenyl)propan-2-ol (PubChem CID 114832741) has the molecular formula C15H13F3O and a molecular weight of 266.26 g/mol. Its IUPAC name is 2-(3,4-difluorophenyl)-1-(2-fluorophenyl)propan-2-ol.

Molecular Properties

Compound Name2-(3,4-difluorophenyl)-1-(2-fluorophenyl)propan-2-ol
PubChem CID114832741
Molecular FormulaC15H13F3O
Molecular Weight266.26 g/mol
Exact Mass266.09
IUPAC Name2-(3,4-difluorophenyl)-1-(2-fluorophenyl)propan-2-ol
SMILESCC(O)(Cc1ccccc1F)c1ccc(F)c(F)c1
InChIInChI=1S/C15H13F3O/c1-15(19,9-10-4-2-3-5-12(10)16)11-6-7-13(17)14(18)8-11/h2-8,19H,9H2,1H3
InChIKeyWTJNSRHCWHWXCN-UHFFFAOYSA-N
XLogP3.55
TPSA20.23 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds3
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500266.26
LogP ≤ 53.55
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

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Related Compounds

1-(2-fluorophenyl)-2-(6-methyl-3-pyridinyl)propan-2-ol
CID 114832739
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
1-(5-chloro-2-fluorophenyl)-2-(4-fluorophenyl)propan-2-ol
CID 103047472
1-(2-chloro-3-fluorophenyl)-2-phenylpropan-2-ol
CID 112652939
2-(2,4-dichloro-5-fluorophenyl)-1-(2-fluorophenyl)propan-2-ol
CID 63406675
1-(5-bromo-2-fluorophenyl)-2-(4-fluorophenyl)propan-2-ol
CID 65145030
1-(5-chloro-2-fluorophenyl)-2-(2-fluorophenyl)propan-2-ol
CID 103047475
1-(3,4-difluorophenyl)-2-(3,4-dimethylphenyl)propan-2-ol
CID 82920068
2-(3,4-difluorophenyl)heptan-2-ol
CID 80557714
2-(3-bromophenyl)-1-(5-chloro-2-fluorophenyl)propan-2-ol
CID 103047480
2-(5-fluoro-2-methoxyphenyl)-1-(2-fluorophenyl)propan-2-ol
CID 114832664

Frequently Asked Questions

What is the IUPAC name of 2-(3,4-difluorophenyl)-1-(2-fluorophenyl)propan-2-ol?
The IUPAC name of 2-(3,4-difluorophenyl)-1-(2-fluorophenyl)propan-2-ol (CID 114832741) is 2-(3,4-difluorophenyl)-1-(2-fluorophenyl)propan-2-ol.
What is the SMILES notation for 2-(3,4-difluorophenyl)-1-(2-fluorophenyl)propan-2-ol?
The canonical SMILES for 2-(3,4-difluorophenyl)-1-(2-fluorophenyl)propan-2-ol is CC(O)(Cc1ccccc1F)c1ccc(F)c(F)c1.
What is the InChIKey of 2-(3,4-difluorophenyl)-1-(2-fluorophenyl)propan-2-ol?
The InChIKey is WTJNSRHCWHWXCN-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H13F3O/c1-15(19,9-10-4-2-3-5-12(10)16)11-6-7-13(17)14(18)8-11/h2-8,19H,9H2,1H3.
What are the key properties of 2-(3,4-difluorophenyl)-1-(2-fluorophenyl)propan-2-ol?
2-(3,4-difluorophenyl)-1-(2-fluorophenyl)propan-2-ol has a molecular weight of 266.26 g/mol, XLogP of 3.55, 3 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(3,4-difluorophenyl)-1-(2-fluorophenyl)propan-2-ol is sourced from PubChem (CID 114832741), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).