4-fluoro-2-(1-hydroxypropyl)phenol

C9H11FO2 — CID 82268240

IUPAC4-fluoro-2-(1-hydroxypropyl)phenol
SMILESCCC(O)c1cc(F)ccc1O
InChIInChI=1S/C9H11FO2/c1-2-8(11)7-5-6(10)3-4-9(7)12/h3-5,8,11-12H,2H2,1H3
InChIKeyLOZIXLUKPYLZSQ-UHFFFAOYSA-N
MW170.18 g/mol
LogP1.97
Rot. Bonds2

About 4-fluoro-2-(1-hydroxypropyl)phenol

4-fluoro-2-(1-hydroxypropyl)phenol (PubChem CID 82268240) has the molecular formula C9H11FO2 and a molecular weight of 170.18 g/mol. Its IUPAC name is 4-fluoro-2-(1-hydroxypropyl)phenol.

Molecular Properties

Compound Name4-fluoro-2-(1-hydroxypropyl)phenol
PubChem CID82268240
Molecular FormulaC9H11FO2
Molecular Weight170.18 g/mol
Exact Mass170.07
IUPAC Name4-fluoro-2-(1-hydroxypropyl)phenol
SMILESCCC(O)c1cc(F)ccc1O
InChIInChI=1S/C9H11FO2/c1-2-8(11)7-5-6(10)3-4-9(7)12/h3-5,8,11-12H,2H2,1H3
InChIKeyLOZIXLUKPYLZSQ-UHFFFAOYSA-N
XLogP1.97
TPSA40.46 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds2
Heavy Atoms12
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500170.18
LogP ≤ 51.97
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

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Related Compounds

1-(2-chloro-5-fluorophenyl)propan-1-ol
CID 105393866
(1S)-1-(2-bromo-5-fluorophenyl)propan-1-ol
CID 103920536
4-fluoro-2-(1-hydroxyethyl)phenol
CID 53406163
(1S)-1-(4-fluoro-2-methylphenyl)propan-1-ol
CID 79002158
(1R)-1-(5-fluoro-2-methoxyphenyl)propan-1-ol
CID 79002413
2-(1,2-diaminobutyl)-4-fluorophenol
CID 130898716
2-[(1S)-1-[[(2R)-butan-2-yl]amino]ethyl]-4-fluorophenol
CID 97050884
2-[(1S)-1-aminobutyl]-4-fluorophenol;hydrochloride
CID 162344095
4-fluoro-2-[1-[[(2S)-1-hydroxybutan-2-yl]amino]ethyl]phenol
CID 104980959
2-[(1S)-1-aminohexyl]-4-fluorophenol
CID 171218475
2-[(1R)-1-aminohexyl]-4-fluorophenol;hydrochloride
CID 171198955
1-(5-fluoro-1H-indol-3-yl)propan-1-ol
CID 118499302

Frequently Asked Questions

What is the IUPAC name of 4-fluoro-2-(1-hydroxypropyl)phenol?
The IUPAC name of 4-fluoro-2-(1-hydroxypropyl)phenol (CID 82268240) is 4-fluoro-2-(1-hydroxypropyl)phenol.
What is the SMILES notation for 4-fluoro-2-(1-hydroxypropyl)phenol?
The canonical SMILES for 4-fluoro-2-(1-hydroxypropyl)phenol is CCC(O)c1cc(F)ccc1O.
What is the InChIKey of 4-fluoro-2-(1-hydroxypropyl)phenol?
The InChIKey is LOZIXLUKPYLZSQ-UHFFFAOYSA-N. The full InChI is InChI=1S/C9H11FO2/c1-2-8(11)7-5-6(10)3-4-9(7)12/h3-5,8,11-12H,2H2,1H3.
What are the key properties of 4-fluoro-2-(1-hydroxypropyl)phenol?
4-fluoro-2-(1-hydroxypropyl)phenol has a molecular weight of 170.18 g/mol, XLogP of 1.97, 2 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 4-fluoro-2-(1-hydroxypropyl)phenol is sourced from PubChem (CID 82268240), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).