4-(2-cyanopropan-2-yl)benzoic acid

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4-(2-cyanopropan-2-yl)benzoic acid Basic information
Product Name:4-(2-cyanopropan-2-yl)benzoic acid
Synonyms:4-(2-cyanopropan-2-yl)benzoic acid;Benzoic acid, 4-(1-cyano-1-methylethyl)-;4-(1-cyano-1-methylethyl)benzoic acid;4-(2-Cyano-2-propyl)benzoic Acid
CAS:129488-74-0
MF:C11H11NO2
MW:189.21
EINECS:
Product Categories:
Mol File:129488-74-0.mol
4-(2-cyanopropan-2-yl)benzoic acid Structure
4-(2-cyanopropan-2-yl)benzoic acid Chemical Properties
Melting point 172-178 °C
Boiling point 356.9±25.0 °C(Predicted)
density 1.167±0.06 g/cm3(Predicted)
storage temp. Sealed in dry,Room Temperature
form solid
pka4.07±0.10(Predicted)
AppearanceWhite to off-white Solid
InChI1S/C11H11NO2/c1-11(2,7-12)9-5-3-8(4-6-9)10(13)14/h3-6H,1-2H3,(H,13,14)
InChIKeyMAVFXLXXHAMJTB-UHFFFAOYSA-N
SMILESCC(C)(C#N)c1ccc(cc1)C(O)=O
Safety Information
Hazard Codes Xn
Risk Statements 22
WGK Germany WGK 3
Storage Class11 - Combustible Solids
Hazard ClassificationsAcute Tox. 4 Oral
MSDS Information
4-(2-cyanopropan-2-yl)benzoic acid Usage And Synthesis
4-(2-cyanopropan-2-yl)benzoic acid Preparation Products And Raw materials
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