Basic information
- CAS
3164-99-6- Standard SMILES
CCC(N=C(N)N)C(=O)O- InChIKey
GSPZXGHHFDORDC-UHFFFAOYSA-N- Molecular formula
- C5H11N3O2
- Average molar mass
- 145.16 g/mol
- Monoisotopic mass
- 145.0851266
Names & identifiers
- Preferred name
- 2-((Aminoiminomethyl)amino)butanoic acid
- IUPAC
- 2-(diaminomethylideneamino)butanoic acid
Names & synonyms
3164-99-62-((Aminoiminomethyl)amino)butanoic acid2-[(Aminoiminomethyl)amino]butanoic acidRefChem:2494852-guanidinobutanoic acidDL-alpha-Guanidinobutyric acidguanidinobutyric acidSCHEMBL345247DTXSID308755862-(Carbamimidoylamino)butanoic acidAKOS006339918Butanoic acid, 2-[(aminoiminomethyl)amino]-
Database identifiers
- CAS
3164-99-6- PubChem CID
- 458593
- DTXSID
DTXSID30875586
Properties
Computed structural properties
- XLogP
- -0.6
- Topological polar surface area
- 102 Ų
- Hydrogen bond donors
- 3
- Hydrogen bond acceptors
- 3
- Rotatable bonds
- 3
- Heavy atoms
- 10
- Formal charge
- 0
- Complexity
- 151
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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