3-Methyloxirane-2-carboxylic acid
Basic information
- CAS
2443-40-5- Standard SMILES
CC1OC1C(=O)O- InChIKey
SEDGGCMDYFKAQN-UHFFFAOYSA-N- Molecular formula
- C4H6O3
- Average molar mass
- 102.09 g/mol
- Monoisotopic mass
- 102.03169405
Names & identifiers
- Preferred name
- 3-Methyloxirane-2-carboxylic acid
- IUPAC
- 3-methyloxirane-2-carboxylic acid
Names & synonyms
3-Methyloxirane-2-carboxylic acid2443-40-5DTXSID70337355RefChem:281175DTXCID60288443SEDGGCMDYFKAQN-UHFFFAOYSA-NMFCD19228166trans-2,3-Epoxy-buttersaureSCHEMBL13167233-Methyloxirane-2-carboxylicacid3-Methyl-2-oxiranecarboxylic acid #AKOS006376247
Show more names
SY398684EN300-210725
Database identifiers
- CAS
2443-40-5- PubChem CID
- 542151
- DTXSID
DTXSID70337355- Nikkaji
- J1.468.938I
Properties
Computed structural properties
- XLogP
- -0.1
- Topological polar surface area
- 49.8 Ų
- Hydrogen bond donors
- 1
- Hydrogen bond acceptors
- 3
- Rotatable bonds
- 1
- Heavy atoms
- 7
- Formal charge
- 0
- Complexity
- 99.1
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Compound notes
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