ChemicalBook--->CAS DataBase List--->42287-94-5

42287-94-5

42287-94-5 Structure

42287-94-5 Structure
IdentificationBack Directory
[Name]

3-(4-CYANOPHENYL)PROPANOIC ACID
[CAS]

42287-94-5
[Synonyms]

4-Cyanohydrocinnamic acid
4-cyanoBenzenepropanoic acid
4-Cyanobenzenepropionic acid
4-(2-Carboxyethyl)benzonitrile
Benzenepropanoic acid,4-cyano-
3-(4-CYANOPHENYL)PROPANOIC ACID
3-(p-Cyanophenyl)propionic acid
[p-Cyanophenyl]-3-propanoic acid
3-(4-CYANO-PHENYL)-PROPIONIC ACID
3-(4-Cyanophenyl)propionicacid,96%
[Molecular Formula]

C10H9NO2
[MDL Number]

MFCD08234823
[MOL File]

42287-94-5.mol
[Molecular Weight]

175.18
Chemical PropertiesBack Directory
[Melting point ]

138-143°C
[Boiling point ]

362.2±25.0 °C(Predicted)
[density ]

1.21±0.1 g/cm3(Predicted)
[storage temp. ]

Inert atmosphere,Room Temperature
[form ]

solid
[pka]

4.50±0.10(Predicted)
[Appearance]

White to off-white Solid
[InChI]

1S/C10H9NO2/c11-7-9-3-1-8(2-4-9)5-6-10(12)13/h1-4H,5-6H2,(H,12,13)
[InChIKey]

RHIGOXBTMPLABF-UHFFFAOYSA-N
[SMILES]

N#Cc1ccc(cc1)CCC(=O)O
Safety DataBack Directory
[Symbol(GHS) ]

Exclamation Mark (GHS07)
GHS07
[Signal word ]

Warning
[Hazard statements ]

H302+H312+H332
[Precautionary statements ]

P261-P264-P280-P301+P312-P302+P352+P312-P304+P340+P312
[Hazard Codes ]

Xn
[Risk Statements ]

20/21/22-22
[Safety Statements ]

36/37
[WGK Germany ]

3
[HazardClass ]

6.1
[HS Code ]

2926907090
[Storage Class]

11 - Combustible Solids
[Hazard Classifications]

Acute Tox. 4 Dermal
Acute Tox. 4 Inhalation
Acute Tox. 4 Oral
Spectrum DetailBack Directory
[Spectrum Detail]

3-(4-CYANOPHENYL)PROPANOIC ACID(42287-94-5)1HNMR
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