3-(4-Methoxybenzoyl)acrylic acid

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Catalog Number
ACM5711411
Product Name
3-(4-Methoxybenzoyl)acrylic acid
Structure
Structure
CAS
5711-41-1
Category
Heterocyclic Organic Compound
Synonyms
Trans-3-(4-methoxybenzoyl)acrylic acid
IUPAC Name
(E)-4-(4-Methoxyphenyl)-4-oxobut-2-enoic acid
Molecular Weight
206.19
Molecular Formula
C11H10O4
Canonical SMILES
COC1=CC=C(C=C1)C(=O)C=CC(=O)O
InChI
InChI=1S/C11H10O4/c1-15-9-4-2-8(3-5-9)10(12)6-7-11(13)14/h2-7H,1H3,(H,13,14)/b7-6+
InChI Key
WORYXBDHTBWLLL-VOTSOKGWSA-N
Boiling Point
389.3±42.0 °C
Melting Point
132-136 °C
Flash Point
155.2ºC
Density
1.240±0.06 g/cm³
Exact Mass
206.0579088
Hazard Statements
Xi
H-Bond Acceptor
4
H-Bond Donor
1
Isomeric SMILES
COC1=CC=C(C=C1)C(=O)/C=C/C(=O)O
Monoisotopic Mass
206.0579088
Safety Description
S26-S36
Topological Polar Surface Area
63.6 Ų
WGK Germany
3
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