2-[3-(dimethylamino)phenyl]acetonitrile

2-[3-(dimethylamino)phenyl]acetonitrile

CAS: 175696-72-7

Formula: C10H12N2

SMILES: CN(C)C1=CC(CC#N)=CC=C1

IUPAC: 2-[3-(dimethylamino)phenyl]acetonitrile

InChI: InChI=1S/C10H12N2/c1-12(2)10-5-3-4-9(8-10)6-7-11/h3-5,8H,6H2,1-2H3

Composition: C (74.97%), H (7.55%), N (17.48%)

Molar Mass: 160.22

Atom Count: 24

Heavy Atom Count: 12

Properties

Properties

Common Names	N/A
Aromatic Ring Count	1
Asymmetric Atom Count	0
Exact Mass	160.100048394
Formal Charge	0
FSP3	0.3
Hetero Ring Count	0
Hydrogen Bond Acceptor Count	2
Hydrogen Bond Donor Count	0
InChIKey	AUKPKUCUMZOTHB-UHFFFAOYSA-N
Lipinski's Rule of Five	1
Molar Refractivity	50.77
Topological Polar Surface Area	27.03
Polarizability	18.68
Ring Count	1
Rotatable Bond Count	2

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95%	<5 Days	175696-72-7		$1,255.00-$3,894.00$1,255.00$1,760.00$3,894.00