Pseudourea, 2-aminoethyl-2-thio-, dinitrate
Basic information
- CAS
3314-99-6- Standard SMILES
N=C(N)SCCN.O=[N+]([O-])O.O=[N+]([O-])O- InChIKey
AMIMGDJGUPWRAQ-UHFFFAOYSA-N- Molecular formula
- C3H11N5O6S
- Average molar mass
- 245.22 g/mol
- Monoisotopic mass
- 245.04300426
Names & identifiers
- Preferred name
- Pseudourea, 2-aminoethyl-2-thio-, dinitrate
- IUPAC
- 2-aminoethyl carbamimidothioate;bis(nitric acid)
Names & synonyms
2-Aminoethylisothiouronium dinitrateUSAF B-52Pseudourea, 2-aminoethyl-2-thio-, dinitratePseudourea, 2-thio-, 2-aminoethyl-, dinitrate3314-99-6RefChem:375760DTXCID60109285DTXSID20186794
Database identifiers
- CAS
3314-99-6- PubChem CID
- 201118
Properties
Computed structural properties
- Topological polar surface area
- 233 Ų
- Hydrogen bond donors
- 5
- Hydrogen bond acceptors
- 9
- Rotatable bonds
- 3
- Heavy atoms
- 15
- Formal charge
- 0
- Complexity
- 88
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Related reactions
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Compound notes
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