1-(3,5-difluorophenyl)-2-(3-fluorophenyl)propan-2-ol

C15H13F3O — CID 105402440

IUPAC1-(3,5-difluorophenyl)-2-(3-fluorophenyl)propan-2-ol
SMILESCC(O)(Cc1cc(F)cc(F)c1)c1cccc(F)c1
InChIInChI=1S/C15H13F3O/c1-15(19,11-3-2-4-12(16)7-11)9-10-5-13(17)8-14(18)6-10/h2-8,19H,9H2,1H3
InChIKeyNXZSDAUYNZFLMC-UHFFFAOYSA-N
MW266.26 g/mol
LogP3.55
Rot. Bonds3

About 1-(3,5-difluorophenyl)-2-(3-fluorophenyl)propan-2-ol

1-(3,5-difluorophenyl)-2-(3-fluorophenyl)propan-2-ol (PubChem CID 105402440) has the molecular formula C15H13F3O and a molecular weight of 266.26 g/mol. Its IUPAC name is 1-(3,5-difluorophenyl)-2-(3-fluorophenyl)propan-2-ol.

Molecular Properties

Compound Name1-(3,5-difluorophenyl)-2-(3-fluorophenyl)propan-2-ol
PubChem CID105402440
Molecular FormulaC15H13F3O
Molecular Weight266.26 g/mol
Exact Mass266.09
IUPAC Name1-(3,5-difluorophenyl)-2-(3-fluorophenyl)propan-2-ol
SMILESCC(O)(Cc1cc(F)cc(F)c1)c1cccc(F)c1
InChIInChI=1S/C15H13F3O/c1-15(19,11-3-2-4-12(16)7-11)9-10-5-13(17)8-14(18)6-10/h2-8,19H,9H2,1H3
InChIKeyNXZSDAUYNZFLMC-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-(4-chlorophenyl)-2-(3-fluorophenyl)propan-2-ol
CID 60798764
2-(3-fluorophenyl)-1-(4-iodophenyl)propan-2-ol
CID 65479485
3-[1-(3,5-difluorophenyl)-2-hydroxypropan-2-yl]benzonitrile
CID 105402704
1-(3,5-difluorophenyl)-2-(4-methylphenyl)propan-2-ol
CID 105402436
(2S)-2-(3-fluorophenyl)pentan-2-ol
CID 93299056
2-(3-fluoro-4-methoxyphenyl)-1-(3-fluorophenyl)propan-2-ol
CID 114833315
1-(3,5-difluorophenyl)-2-(2-fluorophenyl)propan-2-ol
CID 105402442
2-(3-fluorophenyl)pent-4-en-2-ol
CID 22086786
1-(3,5-difluorophenyl)-2-(2-methylphenyl)propan-2-ol
CID 105402437
2-(3-fluorophenyl)-4-methylheptan-2-ol
CID 65145180
1-bromo-1-(3-fluorophenyl)ethanol
CID 143635660
1,2-bis(3-fluorophenyl)butan-2-ol
CID 114872358

Frequently Asked Questions

What is the IUPAC name of 1-(3,5-difluorophenyl)-2-(3-fluorophenyl)propan-2-ol?
The IUPAC name of 1-(3,5-difluorophenyl)-2-(3-fluorophenyl)propan-2-ol (CID 105402440) is 1-(3,5-difluorophenyl)-2-(3-fluorophenyl)propan-2-ol.
What is the SMILES notation for 1-(3,5-difluorophenyl)-2-(3-fluorophenyl)propan-2-ol?
The canonical SMILES for 1-(3,5-difluorophenyl)-2-(3-fluorophenyl)propan-2-ol is CC(O)(Cc1cc(F)cc(F)c1)c1cccc(F)c1.
What is the InChIKey of 1-(3,5-difluorophenyl)-2-(3-fluorophenyl)propan-2-ol?
The InChIKey is NXZSDAUYNZFLMC-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H13F3O/c1-15(19,11-3-2-4-12(16)7-11)9-10-5-13(17)8-14(18)6-10/h2-8,19H,9H2,1H3.
What are the key properties of 1-(3,5-difluorophenyl)-2-(3-fluorophenyl)propan-2-ol?
1-(3,5-difluorophenyl)-2-(3-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 1-(3,5-difluorophenyl)-2-(3-fluorophenyl)propan-2-ol is sourced from PubChem (CID 105402440), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).