1,3-bis(2,3-difluorophenyl)propan-2-ol

C15H12F4O — CID 115788900

IUPAC1,3-bis(2,3-difluorophenyl)propan-2-ol
SMILESOC(Cc1cccc(F)c1F)Cc1cccc(F)c1F
InChIInChI=1S/C15H12F4O/c16-12-5-1-3-9(14(12)18)7-11(20)8-10-4-2-6-13(17)15(10)19/h1-6,11,20H,7-8H2
InChIKeyPQDCVXLMQCCRIM-UHFFFAOYSA-N
MW284.25 g/mol
LogP3.39
Rot. Bonds4

About 1,3-bis(2,3-difluorophenyl)propan-2-ol

1,3-bis(2,3-difluorophenyl)propan-2-ol (PubChem CID 115788900) has the molecular formula C15H12F4O and a molecular weight of 284.25 g/mol. Its IUPAC name is 1,3-bis(2,3-difluorophenyl)propan-2-ol.

Molecular Properties

Compound Name1,3-bis(2,3-difluorophenyl)propan-2-ol
PubChem CID115788900
Molecular FormulaC15H12F4O
Molecular Weight284.25 g/mol
Exact Mass284.08
IUPAC Name1,3-bis(2,3-difluorophenyl)propan-2-ol
SMILESOC(Cc1cccc(F)c1F)Cc1cccc(F)c1F
InChIInChI=1S/C15H12F4O/c16-12-5-1-3-9(14(12)18)7-11(20)8-10-4-2-6-13(17)15(10)19/h1-6,11,20H,7-8H2
InChIKeyPQDCVXLMQCCRIM-UHFFFAOYSA-N
XLogP3.39
TPSA20.23 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds4
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500284.25
LogP ≤ 53.39
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

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Related Compounds

1-(2,3-difluorophenyl)-3-(2-fluorophenyl)propan-2-ol
CID 55095617
1-(3-chloro-2-fluorophenyl)-3-(2,3-difluorophenyl)propan-2-ol
CID 82806467
1-(2,3-difluorophenyl)-4-methylpentan-2-ol
CID 62606503
1-(2,3-difluorophenyl)-3-(3-fluorophenyl)propan-2-ol
CID 55095181
1-(2,3-difluorophenyl)-4,4-dimethylpentan-2-ol
CID 63891069
1-(3-bromo-2,6-difluorophenyl)-3-(2,3-difluorophenyl)propan-2-ol
CID 106274453
1-(2,3-difluorophenyl)dodecan-2-ol
CID 115789113
1-(2-bromo-5-methoxyphenyl)-3-(2,3-difluorophenyl)propan-2-ol
CID 115801395
2-(2,3-difluorophenyl)-1-(oxan-4-yl)ethanol
CID 65149953
1-(2,3-difluorophenyl)-4-methylpent-3-en-2-ol
CID 115817051
1-(2,3-difluorophenyl)-3-(1-ethylimidazol-2-yl)propan-2-ol
CID 115819194
2-(aminomethyl)-3-(2,3-difluorophenyl)propan-1-ol
CID 63215682

Frequently Asked Questions

What is the IUPAC name of 1,3-bis(2,3-difluorophenyl)propan-2-ol?
The IUPAC name of 1,3-bis(2,3-difluorophenyl)propan-2-ol (CID 115788900) is 1,3-bis(2,3-difluorophenyl)propan-2-ol.
What is the SMILES notation for 1,3-bis(2,3-difluorophenyl)propan-2-ol?
The canonical SMILES for 1,3-bis(2,3-difluorophenyl)propan-2-ol is OC(Cc1cccc(F)c1F)Cc1cccc(F)c1F.
What is the InChIKey of 1,3-bis(2,3-difluorophenyl)propan-2-ol?
The InChIKey is PQDCVXLMQCCRIM-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H12F4O/c16-12-5-1-3-9(14(12)18)7-11(20)8-10-4-2-6-13(17)15(10)19/h1-6,11,20H,7-8H2.
What are the key properties of 1,3-bis(2,3-difluorophenyl)propan-2-ol?
1,3-bis(2,3-difluorophenyl)propan-2-ol has a molecular weight of 284.25 g/mol, XLogP of 3.39, 4 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 1,3-bis(2,3-difluorophenyl)propan-2-ol is sourced from PubChem (CID 115788900), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).