Basic information
- CAS
887579-26-2- Standard SMILES
CCOC(=N)CCCc1cccnc1- InChIKey
FJMRWGUVYKOHIM-UHFFFAOYSA-N- Molecular formula
- C11H16N2O
- Average molar mass
- 192.26 g/mol
- Monoisotopic mass
- 192.12626314
Names & identifiers
- Preferred name
- 3-Pyridinebutanimidic acid ethyl ester
- IUPAC
- ethyl 4-pyridin-3-ylbutanimidate
- English name
- 4-PYRIDIN-3-YL-BUTYRIMIDIC ACID ETHYL ESTER
- Molecular formula
- C11H16N2O
- Molecular weight
- 192.26
Names & synonyms
887579-26-23-Pyridinebutanimidic acid ethyl esterethyl 4-pyridin-3-ylbutanimidateEthyl 4-(pyridin-3-yl)butanimidate4-pyridin-3-ylbutyrimidic acid ethyl esterDTXSID00695379AKOS006293615DB-0781694-PYRIDIN-3-YL-BUTYRIMIDIC ACID ETHYL ESTER
Database identifiers
- CAS
887579-26-2- PubChem CID
- 53404384
- DTXSID
DTXSID00695379
Properties
Computed structural properties
- XLogP
- 1.4
- Topological polar surface area
- 46 Ų
- Hydrogen bond donors
- 1
- Hydrogen bond acceptors
- 3
- Rotatable bonds
- 6
- Heavy atoms
- 14
- Formal charge
- 0
- Complexity
- 171
Chemistry & industry
Suppliers2 total
德拜科技有限公司00852-2521 1836
BETAPHARMA[email protected]
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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