ChemicalBook--->CAS DataBase List--->13255-50-0

13255-50-0

13255-50-0 Structure

13255-50-0 Structure
IdentificationBack Directory
[Name]

4-CARBOXALDEHYDE-N-ISOPROPYLBENZAMIDE
[CAS]

13255-50-0
[Synonyms]

Procarbazine Impurity 1
4-formyl-N-isopropylbenzamide
n-isopropyl-4-formylbenzamide
N-Isopropyl-p-formylbenzamide
N-Isopropylterephthalaldehydamide
4-carbaldehyde-N-isopropylbenzamide
4-CARBOXALDEHYDE-N-ISOPROPYLBENZAMIDE
Benzamide, 4-formyl-N-(1-methylethyl)-
[EINECS(EC#)]

236-247-8
[Molecular Formula]

C11H13NO2
[MDL Number]

MFCD03840703
[MOL File]

13255-50-0.mol
[Molecular Weight]

191.23
Chemical PropertiesBack Directory
[Melting point ]

121-123°C
[Boiling point ]

367.8±25.0 °C(Predicted)
[density ]

1.093±0.06 g/cm3(Predicted)
[storage temp. ]

Inert atmosphere,2-8°C
[solubility ]

Chloroform (Slightly), Methanol (Slightly)
[form ]

Solid
[pka]

14.05±0.46(Predicted)
[color ]

White to Light Yellow
[InChI]

InChI=1S/C11H13NO2/c1-8(2)12-11(14)10-5-3-9(7-13)4-6-10/h3-8H,1-2H3,(H,12,14)
[InChIKey]

OMFHZDXZIJJKFP-UHFFFAOYSA-N
[SMILES]

C(NC(C)C)(=O)C1=CC=C(C=O)C=C1
Safety DataBack Directory
[Symbol(GHS) ]

GHS hazard pictograms
GHS07
[Signal word ]

Warning
[Hazard statements ]

H315-H319-H335
[Precautionary statements ]

P261-P305+P351+P338
[HS Code ]

2924297099
Hazard InformationBack Directory
[Uses]

4-Formyl-n-isopropylbenzamide is an metabolite from the oxidation of the anti-neoplastic agent in aqueous solutions.
Spectrum DetailBack Directory
[Spectrum Detail]

4-CARBOXALDEHYDE-N-ISOPROPYLBENZAMIDE(13255-50-0)1HNMR
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