(S)-2-Methyl-4-pentenoic acid
Basic information
- CAS
20626-61-3- Standard SMILES
C=CC[C@H](C)C(=O)O- InChIKey
HVRZYSHVZOELOH-YFKPBYRVSA-N- Molecular formula
- C6H10O2
- Average molar mass
- 114.14 g/mol
- Monoisotopic mass
- 114.06807956
Overview
HVRZYSHVZOELOH-YFKPBYRVSA-N has been reported in Amanita abrupta with data available.
Names & identifiers
- Preferred name
- (S)-2-Methyl-4-pentenoic acid
- IUPAC
- (2S)-2-methylpent-4-enoic acid
Names & synonyms
20626-61-34-Pentenoic acid, 2-methyl-, (2S)-(S)-2-Methyl-4-pentenoic acid(S)-2-methylpent-4-enoic acidSCHEMBL2536422HVRZYSHVZOELOH-YFKPBYRVSA-NAKOS006376238
Database identifiers
- CAS
20626-61-3- PubChem CID
- 7019646
- EC Number
- 195-377-2
- Nikkaji
- J76.000E
Properties
Computed structural properties
- XLogP
- 1.4
- Topological polar surface area
- 37.3 Ų
- Hydrogen bond donors
- 1
- Hydrogen bond acceptors
- 2
- Rotatable bonds
- 3
- Heavy atoms
- 8
- Formal charge
- 0
- Complexity
- 96.7
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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