Butanoic acid, 2-[(1-methylethyl)nitrosoamino]-
Basic information
- CAS
89941-12-8- Standard SMILES
CCC(C(=O)O)N(N=O)C(C)C- InChIKey
DQKIHDIAMSFMLR-UHFFFAOYSA-N- Molecular formula
- C7H14N2O3
- Average molar mass
- 174.2 g/mol
- Monoisotopic mass
- 174.10044231
Names & identifiers
- Preferred name
- Butanoic acid, 2-[(1-methylethyl)nitrosoamino]-
- IUPAC
- 2-[nitroso(propan-2-yl)amino]butanoic acid
Names & synonyms
89941-12-8Butanoic acid, 2-[(1-methylethyl)nitrosoamino]-2-[nitroso(propan-2-yl)amino]butanoic acidNSC525510DTXSID10326223NSC-525510DS-007339
Database identifiers
- CAS
89941-12-8- PubChem CID
- 352239
- DTXSID
DTXSID10326223
Properties
Computed structural properties
- XLogP
- 1.5
- Topological polar surface area
- 70 Ų
- Hydrogen bond donors
- 1
- Hydrogen bond acceptors
- 5
- Rotatable bonds
- 4
- Heavy atoms
- 12
- Formal charge
- 0
- Complexity
- 170
Related reactions
0 records
No reaction records under the current filter.
Compound notes
Loading…