3-(4-Methylbenzoyl)acrylic acid Structure

3-(4-Methylbenzoyl)acrylic acid

Chemical Properties

Melting point 138-140 °C(lit.)
Boiling point 361.8±42.0 °C(Predicted)
Density  1.200±0.06 g/cm3(Predicted)
pka 3.22±0.10(Predicted)
form  solid
BRN  2691231
InChI 1S/C11H10O3/c1-8-2-4-9(5-3-8)10(12)6-7-11(13)14/h2-7H,1H3,(H,13,14)/b7-6+
InChIKey VNJMEFZKYZHWEO-VOTSOKGWSA-N
SMILES Cc1ccc(cc1)C(=O)\C=C\C(O)=O
CAS DataBase Reference 20972-36-5(CAS DataBase Reference)
UNSPSC Code 12352106
NACRES NA.21

Safety

Symbol(GHS) Exclamation Mark (GHS07)
Signal wordWarning
Hazard statements H302-H315-H319-H335
Precautionary statements P261-P280a-P304+P340-P305+P351+P338-P405-P501a
Hazard Codes  Xi,Xn
Risk Statements  36/37/38-22
Safety Statements  26-37/39
WGK Germany  3
HazardClass  IRRITANT
HS Code  2918300090
Storage Class 11 - Combustible Solids
Hazard Classifications Acute Tox. 4 Oral
NFPA 704:
0
2 0

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