3-(4-fluorophenyl)prop-2-en-1-ol

C9H9FO — CID 53401765

IUPAC3-(4-fluorophenyl)prop-2-en-1-ol
SMILESOCC=Cc1ccc(F)cc1
InChIInChI=1S/C9H9FO/c10-9-5-3-8(4-6-9)2-1-7-11/h1-6,11H,7H2
InChIKeyBJVFNYWWCGKVNR-UHFFFAOYSA-N
MW152.17 g/mol
LogP1.83
Rot. Bonds2

About 3-(4-fluorophenyl)prop-2-en-1-ol

3-(4-fluorophenyl)prop-2-en-1-ol (PubChem CID 53401765) has the molecular formula C9H9FO and a molecular weight of 152.17 g/mol. Its IUPAC name is 3-(4-fluorophenyl)prop-2-en-1-ol.

Molecular Properties

Compound Name3-(4-fluorophenyl)prop-2-en-1-ol
PubChem CID53401765
Molecular FormulaC9H9FO
Molecular Weight152.17 g/mol
Exact Mass152.06
IUPAC Name3-(4-fluorophenyl)prop-2-en-1-ol
SMILESOCC=Cc1ccc(F)cc1
InChIInChI=1S/C9H9FO/c10-9-5-3-8(4-6-9)2-1-7-11/h1-6,11H,7H2
InChIKeyBJVFNYWWCGKVNR-UHFFFAOYSA-N
XLogP1.83
TPSA20.23 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds2
Heavy Atoms11
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500152.17
LogP ≤ 51.83
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

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Related Compounds

Cinnamyl Alcohol
CID 5315892
2-Pentylcinnamic alcohol
CID 5368491
3-Phenylprop-2-En-1-Ol
CID 308
2-Pentyl-3-phenylprop-2-en-1-ol
CID 6076971
4-Phenylbut-3-en-2-ol
CID 15172
alpha-Amylcinnamyl alcohol
CID 7584
(3Z)-4-Phenyl-3-buten-2-ol
CID 11469151
4-Phenyl-3-buten-2-ol, (3E)-
CID 5369489
2-Methyl-3-phenyl-2-propen-1-ol
CID 560879
alpha-Methylcinnamic alcohol
CID 6393846
4-Fluorophenethyl Alcohol
CID 82068
2-Fluorobenzylic alcohol
CID 67969

Frequently Asked Questions

What is the IUPAC name of 3-(4-fluorophenyl)prop-2-en-1-ol?
The IUPAC name of 3-(4-fluorophenyl)prop-2-en-1-ol (CID 53401765) is 3-(4-fluorophenyl)prop-2-en-1-ol.
What is the SMILES notation for 3-(4-fluorophenyl)prop-2-en-1-ol?
The canonical SMILES for 3-(4-fluorophenyl)prop-2-en-1-ol is OCC=Cc1ccc(F)cc1.
What is the InChIKey of 3-(4-fluorophenyl)prop-2-en-1-ol?
The InChIKey is BJVFNYWWCGKVNR-UHFFFAOYSA-N. The full InChI is InChI=1S/C9H9FO/c10-9-5-3-8(4-6-9)2-1-7-11/h1-6,11H,7H2.
What are the key properties of 3-(4-fluorophenyl)prop-2-en-1-ol?
3-(4-fluorophenyl)prop-2-en-1-ol has a molecular weight of 152.17 g/mol, XLogP of 1.83, 2 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 3-(4-fluorophenyl)prop-2-en-1-ol is sourced from PubChem (CID 53401765), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).