2-(2-hydroxybut-3-en-2-yl)phenol

C10H12O2 — CID 13380598

IUPAC2-(2-hydroxybut-3-en-2-yl)phenol
SMILESC=CC(C)(O)c1ccccc1O
InChIInChI=1S/C10H12O2/c1-3-10(2,12)8-6-4-5-7-9(8)11/h3-7,11-12H,1H2,2H3
InChIKeySDOYLAIVMWSIJM-UHFFFAOYSA-N
MW164.20 g/mol
LogP1.79
Rot. Bonds2

About 2-(2-hydroxybut-3-en-2-yl)phenol

2-(2-hydroxybut-3-en-2-yl)phenol (PubChem CID 13380598) has the molecular formula C10H12O2 and a molecular weight of 164.20 g/mol. Its IUPAC name is 2-(2-hydroxybut-3-en-2-yl)phenol.

Molecular Properties

Compound Name2-(2-hydroxybut-3-en-2-yl)phenol
PubChem CID13380598
Molecular FormulaC10H12O2
Molecular Weight164.20 g/mol
Exact Mass164.08
IUPAC Name2-(2-hydroxybut-3-en-2-yl)phenol
SMILESC=CC(C)(O)c1ccccc1O
InChIInChI=1S/C10H12O2/c1-3-10(2,12)8-6-4-5-7-9(8)11/h3-7,11-12H,1H2,2H3
InChIKeySDOYLAIVMWSIJM-UHFFFAOYSA-N
XLogP1.79
TPSA40.46 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds2
Heavy Atoms12
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500164.20
LogP ≤ 51.79
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'isolated_alkene', 'substructure': 'N/A'}

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Related Compounds

(2S)-2-(2-chlorophenyl)but-3-en-2-ol
CID 46918958
(2R)-2-(2-methoxyphenyl)but-3-en-2-ol
CID 124509510
2-[(2R,3R)-2-hydroxy-3-methylpent-4-en-2-yl]phenol
CID 14939211
2-[1-[1,1-bis(2-hydroxyphenyl)prop-2-enoxy]-1-(2-hydroxyphenyl)prop-2-enyl]phenol
CID 66963467
3-[2-(3-hydroxypenta-1,4-dien-3-yl)phenyl]penta-1,4-dien-3-ol
CID 154196116
2-[2-(2-hydroxyphenyl)propan-2-yl]phenol;hydrate
CID 162321834
CID 172777673
CID 172777673
2-tert-butylphenol;2-methylprop-1-ene
CID 160954539
potassium;2-tert-butylphenol;hydride
CID 174648142
2-(2-hydroxyphenyl)-2-methylpropanal
CID 88788107
2-tert-butylphenol;2-prop-2-enylphenol
CID 88688446
2-[2-(dimethylamino)propan-2-yl]phenol
CID 66587179

Frequently Asked Questions

What is the IUPAC name of 2-(2-hydroxybut-3-en-2-yl)phenol?
The IUPAC name of 2-(2-hydroxybut-3-en-2-yl)phenol (CID 13380598) is 2-(2-hydroxybut-3-en-2-yl)phenol.
What is the SMILES notation for 2-(2-hydroxybut-3-en-2-yl)phenol?
The canonical SMILES for 2-(2-hydroxybut-3-en-2-yl)phenol is C=CC(C)(O)c1ccccc1O.
What is the InChIKey of 2-(2-hydroxybut-3-en-2-yl)phenol?
The InChIKey is SDOYLAIVMWSIJM-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H12O2/c1-3-10(2,12)8-6-4-5-7-9(8)11/h3-7,11-12H,1H2,2H3.
What are the key properties of 2-(2-hydroxybut-3-en-2-yl)phenol?
2-(2-hydroxybut-3-en-2-yl)phenol has a molecular weight of 164.20 g/mol, XLogP of 1.79, 2 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(2-hydroxybut-3-en-2-yl)phenol is sourced from PubChem (CID 13380598), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).