Basic information
- CAS
5626-63-1- Standard SMILES
O=C(O)C1CCCN1C(=O)O- InChIKey
OAWXZFGKDDFTGS-UHFFFAOYSA-N- Molecular formula
- C6H9NO4
- Average molar mass
- 159.14 g/mol
- Monoisotopic mass
- 159.05315777
Names & identifiers
- Preferred name
- Pyrrolidine-1,2-dicarboxylic acid
- IUPAC
- pyrrolidine-1,2-dicarboxylic acid
- English name
- 1,2-Pyrrolidinedicarboxylicacid(7CI,8CI,9CI)
- Molecular formula
- C6H9NO4
- Molecular weight
- 159.14
Names & synonyms
pyrrolidine-1,2-dicarboxylic acid5626-63-1DTXSID00564137RefChem:378092DTXCID80514913proline carboxylic acidSCHEMBL750903OAWXZFGKDDFTGS-UHFFFAOYSA-N1,2-Pyrrolidinedicarboxylicacid(7CI,8CI,9CI)
Database identifiers
- CAS
5626-63-1- PubChem CID
- 14794868
- DTXSID
DTXSID00564137
Properties
Computed structural properties
- XLogP
- 0.2
- Topological polar surface area
- 77.8 Ų
- Hydrogen bond donors
- 2
- Hydrogen bond acceptors
- 4
- Rotatable bonds
- 1
- Heavy atoms
- 11
- Formal charge
- 0
- Complexity
- 191
Chemistry & industry
Suppliers1 total
Nextpeptide Inc+86-0571-81612335 +8613336028439 · [email protected]
Related reactions
1 records
Compound notes
Loading…