4-(Dimethylamino)-2-phenylbutyronitrile

4-(dimethylamino)-2-phenylbutanenitrile

CAS: 50599-78-5

Molecular Formula	`C12H16N2`
Molecular Weight	188.27 g/mol
LogP	2.0
Topological Polar Surface Area	27.0 A2
Hydrogen Bond Donors	0
Hydrogen Bond Acceptors	2
Rotatable Bonds	4
Exact Mass	188.13135
Heavy Atoms	14
Complexity	196.0

Chemical Identifiers

CAS Number	50599-78-5
SMILES	`CN(C)CCC(C#N)C1=CC=CC=C1`
InChIKey	`SKQMIWWQYUSWFP-UHFFFAOYSA-N`

📖 Product Overview

4-(Dimethylamino)-2-phenylbutyronitrile (CAS: 50599-78-5) is a chemical compound with molecular formula C12H16N2 and molecular weight 188.27 g/mol. Its IUPAC systematic name is 4-(dimethylamino)-2-phenylbutanenitrile. LogP 2.0 Topological Polar Surface Area 27.0 A2 Hydrogen Bond Donors 0 Hydrogen Bond Acceptors 2 Rotatable Bonds 4 Exact Mass 188.13135 Heavy Atoms 14 Complexity 196.0 InChI Key: SKQMIWWQYUSWFP-UHFFFAOYSA-N. SMILES: CN(C)CCC(C#N)C1=CC=CC=C1.

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