Basic information
- CAS
1820614-03-6- Standard SMILES
CCOC(=O)c1cn2cc([N+](=O)[O-])cc(C)c2n1- InChIKey
XMLAYEQYFFCAPQ-UHFFFAOYSA-N- Molecular formula
- C11H11N3O4
- Average molar mass
- 249.22 g/mol
- Monoisotopic mass
- 249.07495584
Names & identifiers
- Preferred name
- Ethyl 8-methyl-6-nitroimidazo[1,2-a]pyridine-2-carboxylate
- IUPAC
- ethyl 8-methyl-6-nitroimidazo[1,2-a]pyridine-2-carboxylate
- English name
- Ethyl 8-methyl-6-nitroimidazo[1,2-a]pyridine-2-carboxylate
- Molecular formula
- C11H11N3O4
- Molecular weight
- 249.22
Names & synonyms
Ethyl 8-methyl-6-nitroimidazo[1,2-a]pyridine-2-carboxylate1820614-03-6MFCD28143975BS-31464CS-0090919D74992F611033Ethyl8-methyl-6-nitroimidazo[1,2-a]pyridine-2-carboxylateethyl 8-methyl-6-nitro-imidazo[1,2-a]pyridine-2-carboxylate8-Methyl-6-nitro-imidazo[1,2-a]pyridine-2-carboxylic acid ethyl esterImidazo[1,2-a]pyridine-2-carboxylic acid, 8-methyl-6-nitro-, ethyl ester
Database identifiers
- CAS
1820614-03-6- PubChem CID
- 91659205
Properties
Computed structural properties
- XLogP
- 2.5
- Topological polar surface area
- 89.4 Ų
- Hydrogen bond donors
- 0
- Hydrogen bond acceptors
- 5
- Rotatable bonds
- 3
- Heavy atoms
- 18
- Formal charge
- 0
- Complexity
- 344
Physicochemical properties
- Density
- 1.41 · 1.41±0.1 g/cm3(Predicted)
- pka
- 0.71 · 0.71±0.50(Predicted)
Chemistry & industry
Suppliers4 total
杭州摩库生物医药科技有限公司+86-057181025280; +8617767106207 · [email protected]
苏州亚衍医药科技有限公司17715136450 · [email protected]
上海奈亦斯生物科技有限公司18321139117 · [email protected]
上海皓鸿生物医药科技有限公司400-8210725 4008210725 · [email protected]
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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