2-N,2-N,4-N,4-N-tetramethyl-5-nitropyrimidine-2,4-diamine
Basic information
- CAS
1137-13-9- Standard SMILES
CN(C)c1ncc([N+](=O)[O-])c(N(C)C)n1- InChIKey
WHTLEFOMOMTSES-UHFFFAOYSA-N- Molecular formula
- C8H13N5O2
- Average molar mass
- 211.22 g/mol
- Monoisotopic mass
- 211.10692467
Names & identifiers
- Preferred name
- 2-N,2-N,4-N,4-N-tetramethyl-5-nitropyrimidine-2,4-diamine
- IUPAC
- 2-N,2-N,4-N,4-N-tetramethyl-5-nitropyrimidine-2,4-diamine
Names & synonyms
1137-13-9NSC22487DTXSID40921164NSC-22487DS-0036492,4-Pyrimidinediamine,n2,n2,n4,n4-tetramethyl-5-nitro-N~2~,N~2~,N~4~,N~4~-Tetramethyl-5-nitropyrimidine-2,4-diamine
Database identifiers
- CAS
1137-13-9- PubChem CID
- 229084
- DTXSID
DTXSID40921164
Properties
Computed structural properties
- XLogP
- 0.9
- Topological polar surface area
- 78.1 Ų
- Hydrogen bond donors
- 0
- Hydrogen bond acceptors
- 6
- Rotatable bonds
- 2
- Heavy atoms
- 15
- Formal charge
- 0
- Complexity
- 228
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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