Basic information
- CAS
13992-53-5- Standard SMILES
CNc1c([N+](=O)[O-])c(=O)n(C)c(=O)n1C- InChIKey
YPENWWBLQQJRDL-UHFFFAOYSA-N- Molecular formula
- C7H10N4O4
- Average molar mass
- 214.18 g/mol
- Monoisotopic mass
- 214.07020481
Names & identifiers
- Preferred name
- 1,3-Dimethyl-6-(methylamino)-5-nitropyrimidine-2,4-dione
- IUPAC
- 1,3-dimethyl-6-(methylamino)-5-nitropyrimidine-2,4-dione
- English name
- 1,3-Dimethyl-6-(methylamino)-5-nitrouracil
- Molecular weight
- 0
Names & synonyms
13992-53-5Uracil, 1,3-dimethyl-6-(methylamino)-5-nitro-N6GHV54DNU1,3-dimethyl-6-(methylamino)-5-nitropyrimidine-2,4-dioneNSC-90341DTXSID90161199RefChem:196791DTXCID80836901,3-Dimethyl-6-methylamino-5-nitrouracil2,4(1H,3H)-Pyrimidinedione, 1,3-dimethyl-6-(methylamino)-5-nitro-1,3-dimethyl-6-(methylamino)-5-nitro-1,2,3,4-tetrahydropyrimidine-2,4-dioneNSC 90341
Show more names
1,3-Dimethyl-6-methylamino-5-nitro-1H-pyrimidine-2,4-dione1,3-Dimethyl-6-(methylamino)-5-nitro-2,4(1H,3H)-pyrimidinedione
BRN 0657105NSC90341UNII-N6GHV54DNU1,3-Dimethyl-6-(methylamino)-5-nitrouracilNCIOpen2_0054695-25-15-00421 (Beilstein Handbook Reference)SCHEMBL2445185HS-3116
Database identifiers
- CAS
13992-53-5- PubChem CID
- 96841
- DTXSID
DTXSID90161199
Properties
Computed structural properties
- XLogP
- 0.2
- Topological polar surface area
- 98.5 Ų
- Hydrogen bond donors
- 1
- Hydrogen bond acceptors
- 5
- Rotatable bonds
- 1
- Heavy atoms
- 15
- Formal charge
- 0
- Complexity
- 370
Physicochemical properties
- FDA UNII
- 6 GHV54DNU · N6GHV54DNU
Chemistry & industry
Upstream & downstream products
Downstream products
Suppliers1 total
南京世洲生物科技有限公司17301488900 · [email protected]
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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