Basic information
- CAS
33952-02-2- Standard SMILES
N=C(N[N+](=O)[O-])N(CCCl)N=O- InChIKey
FFEKCHZAPPEOBH-UHFFFAOYSA-N- Molecular formula
- C3H6ClN5O3
- Average molar mass
- 195.56 g/mol
- Monoisotopic mass
- 195.0159168
Names & identifiers
- Preferred name
- CID 136232102
- IUPAC
- 1-(2-chloroethyl)-3-nitro-1-nitrosoguanidine
Names & synonyms
DTXSID90955530
Database identifiers
- CAS
33952-02-2- PubChem CID
- 136232102
- DTXSID
DTXSID90955530
Properties
Computed structural properties
- XLogP
- 0.6
- Topological polar surface area
- 114 Ų
- Hydrogen bond donors
- 2
- Hydrogen bond acceptors
- 5
- Rotatable bonds
- 4
- Heavy atoms
- 12
- Formal charge
- 0
- Complexity
- 191
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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