Basic information
- CAS
57956-33-9- Standard SMILES
CCOC(=O)N1C=CC=CC1- InChIKey
QQJYBYUSURJAFG-UHFFFAOYSA-N- Molecular formula
- C8H11NO2
- Average molar mass
- 153.18 g/mol
- Monoisotopic mass
- 153.07897859
Names & identifiers
- Preferred name
- Ethyl pyridine-1(2H)-carboxylate
- IUPAC
- ethyl 2H-pyridine-1-carboxylate
- English name
- 1(2H)-Pyridinecarboxylicacid,ethylester(9CI)
- Molecular formula
- C8H11NO2
- Molecular weight
- 153.18
Names & synonyms
57956-33-9Ethyl pyridine-1(2H)-carboxylateDTXSID90494833RefChem:345000DTXCID90445643N-(ethoxycarbonyl)pyridineSCHEMBL4771331SCHEMBL7637509SCHEMBL7637512Ethyl 1(2h)-pyridinecarboxylateDB-230325N-(ethoxycarbonyl)-1,2-dihydropyridine
Show more names
1(2H)-Pyridinecarboxylic acid, ethyl ester1(2H)-Pyridinecarboxylicacid,ethylester(9CI)
Database identifiers
- CAS
57956-33-9- PubChem CID
- 12371301
- DTXSID
DTXSID90494833- Nikkaji
- J1.521.625E
Properties
Computed structural properties
- XLogP
- 1.3
- Topological polar surface area
- 29.5 Ų
- Hydrogen bond donors
- 0
- Hydrogen bond acceptors
- 2
- Rotatable bonds
- 2
- Heavy atoms
- 11
- Formal charge
- 0
- Complexity
- 196
Chemistry & industry
Suppliers1 total
CHEMSTEP[email protected]
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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