Basic information
- CAS
5872-56-0- Standard SMILES
O=C(O)CC(C(=O)O)N1CCCC1- InChIKey
GWYJLFWOAHSKMB-UHFFFAOYSA-N- Molecular formula
- C8H13NO4
- Average molar mass
- 187.19 g/mol
- Monoisotopic mass
- 187.0844579
Names & identifiers
- Preferred name
- 2-(Pyrrolidin-1-yl)butanedioic acid
- IUPAC
- 2-pyrrolidin-1-ylbutanedioic acid
Names & synonyms
5872-56-0DTXSID309742452-(Pyrrolidin-1-yl)butanedioic acidRefChem:1062044DTXCID701401676DL-1-Pyrrolidinesuccinic acid1-Pyrrolidinesuccinic acid, DL-2-(pyrrolidin-1-yl)succinic acidAKOS020228755
Database identifiers
- CAS
5872-56-0- PubChem CID
- 201380
- DTXSID
DTXSID30974245
Properties
Computed structural properties
- XLogP
- -2.4
- Topological polar surface area
- 77.8 Ų
- Hydrogen bond donors
- 2
- Hydrogen bond acceptors
- 5
- Rotatable bonds
- 4
- Heavy atoms
- 13
- Formal charge
- 0
- Complexity
- 210
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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