3-(4-Pyridinyl)-2-propenoic acid
Properties
- Molecular formula
- C8H7NO2
- Molar mass
- 149.15 g/mol
- Exact mass
- 149.0477 Da
- Melting point
- 293–295 °C
- logP
- 1.18Crippen estimate
- Polar surface area
- 50.2 Ų
- H-bond donors / acceptors
- 1 / 2
- Rotatable bonds
- 2
Hazards
No GHS classification is on file for this compound. That is not evidence that it is harmless.
Identifiers
CAS number
5337-79-1SMILES
O=C(O)C=Cc1ccncc1InChIKey
SSAYTINUCCRGDR-UHFFFAOYSA-NInChI
InChI=1S/C8H7NO2/c10-8(11)2-1-7-3-5-9-6-4-7/h1-6H,(H,10,11)Weigh it out
Type any one amount. The others follow from the molar mass.
Names and synonyms
8 names
- 2-Propenoic acid, 3-(4-pyridinyl)-
- 4-Pyridineacrylic acid
- 3-(4-Pyridyl)acrylic acid
- 4-Pyridylacrylic acid
- 3-(4-Pyridyl)-2-propenoic acid
- 3-(Pyridin-4-yl)-2-propenoic acid
- 3-(4-Pyridinyl)acrylic acid
- NSC 830
Work with 3-(4-Pyridinyl)-2-propenoic acid
Stereoisomers, salts and isotopologues
The same compound in another form: other stereochemistry, a salt or hydrate, the free acid or base, or an isotope-labelled version.
Similar compounds
p-Phenylenediacrylic acid16323-43-673 % similar
Cinnamic acid140-10-366 % similar
Cinnamic acid621-82-966 % similar
3-(4-Formylphenyl)-2-propenoic acid23359-08-261 % similar
P-Coumaric acid501-98-461 % similar
p-Coumaric acid7400-08-061 % similar
4-Bromocinnamic acid1200-07-359 % similar
trans-4-Fluorocinnamic acid14290-86-959 % similar
Tanimoto similarity of circular fingerprints over the whole catalogue.