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

C9H10F2O — CID 53434260

IUPAC3-(2,3-difluorophenyl)propan-1-ol
SMILESOCCCc1cccc(F)c1F
InChIInChI=1S/C9H10F2O/c10-8-5-1-3-7(9(8)11)4-2-6-12/h1,3,5,12H,2,4,6H2
InChIKeyRWNQBRQNSJNKAG-UHFFFAOYSA-N
MW172.17 g/mol
LogP1.89
Rot. Bonds3

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

3-(2,3-difluorophenyl)propan-1-ol (PubChem CID 53434260) has the molecular formula C9H10F2O and a molecular weight of 172.17 g/mol. Its IUPAC name is 3-(2,3-difluorophenyl)propan-1-ol.

Molecular Properties

Compound Name3-(2,3-difluorophenyl)propan-1-ol
PubChem CID53434260
Molecular FormulaC9H10F2O
Molecular Weight172.17 g/mol
Exact Mass172.07
IUPAC Name3-(2,3-difluorophenyl)propan-1-ol
SMILESOCCCc1cccc(F)c1F
InChIInChI=1S/C9H10F2O/c10-8-5-1-3-7(9(8)11)4-2-6-12/h1,3,5,12H,2,4,6H2
InChIKeyRWNQBRQNSJNKAG-UHFFFAOYSA-N
XLogP1.89
TPSA20.23 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds3
Heavy Atoms12
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500172.17
LogP ≤ 51.89
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

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Related Compounds

1-(3-bromopropyl)-2,3-difluorobenzene
CID 53433974
4-(2,3-difluorophenyl)butanoic acid
CID 59862325
2,3-difluoro-6-(3-hydroxypropyl)phenol
CID 117280989
3-(2,4-difluoro-3-methylphenyl)propan-1-ol
CID 66733705
1-(4-chloropentyl)-2,3-difluorobenzene
CID 64516100
(2,3-difluorophenyl)methanamine
CID 2736941
1,2-difluoro-3-(iodomethyl)benzene
CID 64789130
1,3-bis(2,3-difluorophenyl)propan-2-ol
CID 115788900
3-naphthalen-1-ylpropan-1-ol
CID 14711518
2-(2,3-difluorophenyl)acetic acid;hydrochloride
CID 172702403
3-(2,3-difluorophenoxy)propan-1-ol
CID 63037951
5-chloro-1-(2,3-difluorophenyl)pentan-2-one
CID 66044922

Frequently Asked Questions

What is the IUPAC name of 3-(2,3-difluorophenyl)propan-1-ol?
The IUPAC name of 3-(2,3-difluorophenyl)propan-1-ol (CID 53434260) is 3-(2,3-difluorophenyl)propan-1-ol.
What is the SMILES notation for 3-(2,3-difluorophenyl)propan-1-ol?
The canonical SMILES for 3-(2,3-difluorophenyl)propan-1-ol is OCCCc1cccc(F)c1F.
What is the InChIKey of 3-(2,3-difluorophenyl)propan-1-ol?
The InChIKey is RWNQBRQNSJNKAG-UHFFFAOYSA-N. The full InChI is InChI=1S/C9H10F2O/c10-8-5-1-3-7(9(8)11)4-2-6-12/h1,3,5,12H,2,4,6H2.
What are the key properties of 3-(2,3-difluorophenyl)propan-1-ol?
3-(2,3-difluorophenyl)propan-1-ol has a molecular weight of 172.17 g/mol, XLogP of 1.89, 3 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 3-(2,3-difluorophenyl)propan-1-ol is sourced from PubChem (CID 53434260), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).