Basic information
- CAS
6336-19-2- Standard SMILES
CSCCN=C(N)N[N+](=O)[O-]- InChIKey
YUTXEKSZDOBMHQ-UHFFFAOYSA-N- Molecular formula
- C4H10N4O2S
- Average molar mass
- 178.22 g/mol
- Monoisotopic mass
- 178.05244675
Names & identifiers
- Preferred name
- 2-(2-Methylsulfanylethyl)-1-nitroguanidine
- IUPAC
- 2-(2-methylsulfanylethyl)-1-nitroguanidine
Names & synonyms
6336-19-22-(2-methylsulfanylethyl)-1-nitroguanidineDTXSID30328603NSC39276NSC-39276N''-[2-(Methylsulfanyl)ethyl]-N-nitroguanidine
Database identifiers
- CAS
6336-19-2- PubChem CID
- 412368
- DTXSID
DTXSID30328603
Properties
Computed structural properties
- XLogP
- -0.1
- Topological polar surface area
- 122 Ų
- Hydrogen bond donors
- 2
- Hydrogen bond acceptors
- 4
- Rotatable bonds
- 4
- Heavy atoms
- 11
- Formal charge
- 0
- Complexity
- 155
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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