Glycine, N-nitro-N-(2,2,2-trinitroethyl)-, methyl ester
Basic information
- CAS
56007-01-3- Standard SMILES
COC(=O)CN(CC([N+](=O)[O-])([N+](=O)[O-])[N+](=O)[O-])[N+](=O)[O-]- InChIKey
QKURMCUXUZLJBT-UHFFFAOYSA-N- Molecular formula
- C5H7N5O10
- Average molar mass
- 297.14 g/mol
- Monoisotopic mass
- 297.01929144
Names & identifiers
- Preferred name
- Glycine, N-nitro-N-(2,2,2-trinitroethyl)-, methyl ester
- IUPAC
- methyl 2-[nitro(2,2,2-trinitroethyl)amino]acetate
Names & synonyms
N-Nitro-N-(2,2,2-trinitroethyl)glycine methyl esterGLYCINE, N-NITRO-N-(2,2,2-TRINITROETHYL)-, METHYL ESTER56007-01-3DTXSID70204578RefChem:346579DTXCID00127069Methyl [nitro(2,2,2-trinitroethyl)amino]acetate
Database identifiers
- CAS
56007-01-3- PubChem CID
- 41686
- DTXSID
DTXSID70204578- Nikkaji
- J75.749G
Properties
Computed structural properties
- XLogP
- 0.4
- Topological polar surface area
- 213 Ų
- Hydrogen bond donors
- 0
- Hydrogen bond acceptors
- 11
- Rotatable bonds
- 5
- Heavy atoms
- 20
- Formal charge
- 0
- Complexity
- 403
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Related reactions
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Compound notes
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