Basic information
- CAS
58246-55-2- Standard SMILES
COC(=O)[C@@H]1CCCN1[N+](=O)[O-]- InChIKey
BIGNNGDFCIFIHR-YFKPBYRVSA-N- Molecular formula
- C6H10N2O4
- Average molar mass
- 174.15 g/mol
Names & identifiers
- Preferred name
- L-Proline, 1-nitro-, methyl ester
- IUPAC
- methyl (2S)-1-nitropyrrolidine-2-carboxylate
- English name
- L-Proline, 1-nitro-, methyl ester (9CI)
- Molecular formula
- C6H10N2O4
- Molecular weight
- 174.15
Names & synonyms
58246-55-2DB-326547L-PROLINE, 1-NITRO-, METHYL ESTERL-Proline, 1-nitro-, methyl ester (9CI)
Database identifiers
- CAS
58246-55-2
Properties
Computed structural properties
- XLogP
- 1.1
- Topological polar surface area
- 75.4 Ų
- Hydrogen bond donors
- 0
- Hydrogen bond acceptors
- 5
- Rotatable bonds
- 2
- Heavy atoms
- 12
- Formal charge
- 0
- Complexity
- 200
Chemistry & industry
Suppliers1 total
CHEMSTEP[email protected]
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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