Basic information
- CAS
148694-03-5- Standard SMILES
CC1=C(CO)C(=O)CC1- InChIKey
VBOYONXEJMSAAT-UHFFFAOYSA-N- Molecular formula
- C7H10O2
- Average molar mass
- 126.15 g/mol
- Monoisotopic mass
- 126.06807956
Overview
2-Hydroxymethyl-3-methylcyclopent-2-enon is a cyclic ketone.
Names & identifiers
- Preferred name
- 2-Hydroxymethyl-3-methylcyclopent-2-enone
- IUPAC
- 2-(hydroxymethyl)-3-methylcyclopent-2-en-1-one
Names & synonyms
2-hydroxymethyl-3-methylcyclopent-2-enone2HMMC cpdRefChem:9099352-(Hydroxymethyl)-3-methylcyclopent-2-en-1-one148694-03-52-Hydroxymethyl-3-methylcyclopent-2-enon2-(hydroxymethyl)-3-methyl-2-cyclopenten-1-one2-(hydroxymethyl)-3-methyl-2-cyclopentene-1-oneCHEMBL458459SCHEMBL5086158DTXSID10578144CHEBI:219904
Show more names
VBOYONXEJMSAAT-UHFFFAOYSA-N
Database identifiers
- CAS
148694-03-5- PubChem CID
- 15768146
- DTXSID
DTXSID10578144- ChEMBL
CHEMBL458459- ChEBI
CHEBI:219904- Nikkaji
- J1.352.618D
Properties
Computed structural properties
- XLogP
- 0.1
- Topological polar surface area
- 37.3 Ų
- Hydrogen bond donors
- 1
- Hydrogen bond acceptors
- 2
- Rotatable bonds
- 1
- Heavy atoms
- 9
- Formal charge
- 0
- Complexity
- 168
Related reactions
4 records
Compound notes
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