Crotonic acid

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Catalog Number
ACM107937
Product Name
Crotonic acid
Structure
Structure
CAS
107-93-7
Category
Heterocyclic Organic Compound
Synonyms
(2E)-2-Butenoic acid
IUPAC Name
(E)-But-2-enoic acid
Molecular Weight
86.09
Molecular Formula
C4H6O2
Canonical SMILES
CC=CC(=O)O
InChI
InChI=1S/C4H6O2/c1-2-3-4(5)6/h2-3H,1H3,(H,5,6)/b3-2+
InChI Key
LDHQCZJRKDOVOX-NSCUHMNNSA-N
Boiling Point
180-181 °C(lit.)
Melting Point
70-72 °C(lit.)
Flash Point
190 °F
Density
1.027 g/mL at 25 °C(lit.)
Solubility
Slightly soluble in water
Appearance
Solid
Storage
Store below +30 °C
Complexity
73.6
Exact Mass
86.036779430
Isomeric SMILES
C/C=C/C(=O)O
Monoisotopic Mass
86.036779430
pKa
4.69(at 25 °C)
Refractive Index
1.4228
Topological Polar Surface Area
37.3 Ų
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