CAS
942077-12-5 Purity
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942077-12-5 Purity
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N-Methyl-N-cyanoethyl-p-amino benzaldehyde
CAS
94-21-3
Catalog Number
ACM94213
Category
Other Products
Molecular Weight
188.23
Molecular Formula
C11H12N2O
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Specification
Synonyms
523860_ALDRICH, EINECS 202-315-0, 4-[(2-Cyanoethyl)methylamino]benzaldehyde, 4-((2-Cyanoethyl)methylamino)benzaldehyde, 3-((4-Formylphenyl)methylamino)propiononitrile, Propanenitrile, 3-((4-formylphenyl)methylamino)-, Propanenitrile, 3-[(4-formylphenyl)methylamino]-, P-IN-(2-CYANOETHYL)-METHYLAMINO)-BENZALDEHYDE, 94-21-3
IUPAC Name
3-(4-formyl-N-methylanilino)propanenitrile
SMILES
CN(CCC#N)C1=CC=C(C=C1)C=O
InChI Key
DNRTTXXWWAKULZ-UHFFFAOYSA-N
Boiling Point
387.1ºC at 760 mmHg
Melting Point
70-74ºC
Flash Point
187.9ºC
Density
1.137 g/cm³
EC Number
202-315-0
Exact Mass
188.09500
Hazard Statements
Xn:Harmful;
H-Bond Acceptor
3
H-Bond Donor
0
Safety Description
S26-S36
WGK Germany
3
What is the molecular formula of N-Methyl-N-cyanoethyl-p-amino benzaldehyde?
The molecular formula is C11H12N2O.
What is the molecular weight of N-Methyl-N-cyanoethyl-p-amino benzaldehyde?
The molecular weight is 188.23 g/mol.
What is the IUPAC name of N-Methyl-N-cyanoethyl-p-amino benzaldehyde?
The IUPAC name is 3-(4-formyl-N-methylanilino)propanenitrile.
What is the InChI of N-Methyl-N-cyanoethyl-p-amino benzaldehyde?
The InChI is InChI=1S/C11H12N2O/c1-13(8-2-7-12)11-5-3-10(9-14)4-6-11/h3-6,9H,2,8H2,1H3.
What is the InChIKey of N-Methyl-N-cyanoethyl-p-amino benzaldehyde?
The InChIKey is DNRTTXXWWAKULZ-UHFFFAOYSA-N.
What is the canonical SMILES of N-Methyl-N-cyanoethyl-p-amino benzaldehyde?
The canonical SMILES is CN(CCC#N)C1=CC=C(C=C1)C=O.
What is the CAS number of N-Methyl-N-cyanoethyl-p-amino benzaldehyde?
The CAS number is 94-21-3.
What is the European Community (EC) number of N-Methyl-N-cyanoethyl-p-amino benzaldehyde?
The EC number is 202-315-0.
What is the molecular weight of N-Methyl-N-cyanoethyl-p-amino benzaldehyde according to PubChem?
The molecular weight is 188.23 g/mol according to PubChem.
Is N-Methyl-N-cyanoethyl-p-amino benzaldehyde a canonicalized compound?
Yes, N-Methyl-N-cyanoethyl-p-amino benzaldehyde is a canonicalized compound according to PubChem.
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