Basic information
- Standard SMILES
COC(=O)C=Cc1ccncc1- InChIKey
LDVKAIRVYWBGHI-UHFFFAOYSA-N- Molecular formula
- C9H9NO2
- Average molar mass
- 163.17 g/mol
Names & identifiers
- Preferred name
- 3-Pyridin-4-YL-acrylic acid methyl ester
- IUPAC
- methyl 3-pyridin-4-ylprop-2-enoate
Names & synonyms
3-PYRIDIN-4-YL-ACRYLIC ACID METHYL ESTERMETHYL-3-(4-PYRIDYL)ACRYLATE(Z)-Methyl 3-(pyridin-4-yl)acrylate4-Pyridineacrylic acid methyl esterSCHEMBL4683429methyl 3-(4-pyridinyl)acrylatemethyl 3-(4-pyridyl)propenoateLDVKAIRVYWBGHI-UHFFFAOYSA-Nmethyl 3-(4-pyridinyl)propenoateGDA12449methyl 3-(4-pyridyl)prop-2-enoateSB38497
Show more names
SB52893DB-074694
Database identifiers
- PubChem CID
- 98163
Properties
Computed structural properties
- XLogP
- 1.1
- Topological polar surface area
- 39.2 Ų
- Hydrogen bond donors
- 0
- Hydrogen bond acceptors
- 3
- Rotatable bonds
- 3
- Heavy atoms
- 12
- Formal charge
- 0
- Complexity
- 171
Related reactions
6 records
Linked notes
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