2-(2,3-difluorophenyl)prop-2-en-1-ol

C9H8F2O — CID 118140885

IUPAC2-(2,3-difluorophenyl)prop-2-en-1-ol
SMILESC=C(CO)c1cccc(F)c1F
InChIInChI=1S/C9H8F2O/c1-6(5-12)7-3-2-4-8(10)9(7)11/h2-4,12H,1,5H2
InChIKeySQSUSEHQERHJPE-UHFFFAOYSA-N
MW170.16 g/mol
LogP1.97
Rot. Bonds2

About 2-(2,3-difluorophenyl)prop-2-en-1-ol

2-(2,3-difluorophenyl)prop-2-en-1-ol (PubChem CID 118140885) has the molecular formula C9H8F2O and a molecular weight of 170.16 g/mol. Its IUPAC name is 2-(2,3-difluorophenyl)prop-2-en-1-ol.

Molecular Properties

Compound Name2-(2,3-difluorophenyl)prop-2-en-1-ol
PubChem CID118140885
Molecular FormulaC9H8F2O
Molecular Weight170.16 g/mol
Exact Mass170.05
IUPAC Name2-(2,3-difluorophenyl)prop-2-en-1-ol
SMILESC=C(CO)c1cccc(F)c1F
InChIInChI=1S/C9H8F2O/c1-6(5-12)7-3-2-4-8(10)9(7)11/h2-4,12H,1,5H2
InChIKeySQSUSEHQERHJPE-UHFFFAOYSA-N
XLogP1.97
TPSA20.23 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds2
Heavy Atoms12
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500170.16
LogP ≤ 51.97
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

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Related Compounds

1,2-difluoro-3-(3-iodoprop-1-en-2-yl)benzene
CID 18993725
(E)-3-chloro-3-(2,3-difluorophenyl)prop-2-en-1-ol
CID 145207122
1-(2,3-difluorophenyl)but-3-en-1-one
CID 116659426
2,3-difluorobenzoyl bromide
CID 91168195
1,2,3-trifluorobenzene
CID 15147
1-(2,3-difluorophenyl)propan-1-one;ethane
CID 158876194
2-amino-1-(2,3-difluorophenyl)ethanone;hydrochloride
CID 122360971
1-fluoro-2-(3-iodoprop-1-en-2-yl)benzene
CID 140862790
1-but-1-en-2-yl-3-chloro-2-fluorobenzene
CID 169245577
2,3-difluoro-N-(methylaminomethyl)benzamide
CID 140814501
N-(2-chloroprop-2-enylsulfonyl)-2,3-difluorobenzamide
CID 75522733
ethyl 2,3-difluorobenzoate
CID 2761174

Frequently Asked Questions

What is the IUPAC name of 2-(2,3-difluorophenyl)prop-2-en-1-ol?
The IUPAC name of 2-(2,3-difluorophenyl)prop-2-en-1-ol (CID 118140885) is 2-(2,3-difluorophenyl)prop-2-en-1-ol.
What is the SMILES notation for 2-(2,3-difluorophenyl)prop-2-en-1-ol?
The canonical SMILES for 2-(2,3-difluorophenyl)prop-2-en-1-ol is C=C(CO)c1cccc(F)c1F.
What is the InChIKey of 2-(2,3-difluorophenyl)prop-2-en-1-ol?
The InChIKey is SQSUSEHQERHJPE-UHFFFAOYSA-N. The full InChI is InChI=1S/C9H8F2O/c1-6(5-12)7-3-2-4-8(10)9(7)11/h2-4,12H,1,5H2.
What are the key properties of 2-(2,3-difluorophenyl)prop-2-en-1-ol?
2-(2,3-difluorophenyl)prop-2-en-1-ol has a molecular weight of 170.16 g/mol, XLogP of 1.97, 2 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(2,3-difluorophenyl)prop-2-en-1-ol is sourced from PubChem (CID 118140885), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).