propan-2-yl (2S,3S)-3-methyloxirane-2-carboxylate
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Basic information
- CAS
221203-37-8- Standard SMILES
CC(C)OC(=O)[C@H]1O[C@H]1C- InChIKey
PWNWKHJXYOLVTK-WDSKDSINSA-N- Molecular formula
- C7H12O3
- Average molar mass
- 144.17 g/mol
- Monoisotopic mass
- 144.07864424
Names & identifiers
- Preferred name
- propan-2-yl (2S,3S)-3-methyloxirane-2-carboxylate
- IUPAC
- propan-2-yl (2S,3S)-3-methyloxirane-2-carboxylate
- English name
- Oxiranecarboxylic acid, 3-methyl-, 1-methylethyl ester, (2S,3S)- (9CI)
- Molecular formula
- C7H12O3
- Molecular weight
- 144.16838
Names & synonyms
Oxiranecarboxylic acid, 3-methyl-, 1-methylethyl ester, (2S,3S)- (9CI)
Database identifiers
- CAS
221203-37-8- PubChem CID
- 45090017
- Nikkaji
- J1.068.963E
Properties
Computed structural propertiesFilling in
- XLogP
- 1
- Topological polar surface area
- 38.8 Ų
- Hydrogen bond donors
- 0
- Hydrogen bond acceptors
- 3
- Rotatable bonds
- 3
- Heavy atoms
- 10
- Formal charge
- 0
- Complexity
- 142
Related reactions
0 records
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Compound notes
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