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115279-57-7 | Benzeneacetonitrile, 4-amino-α,α-dimethyl-
CAS No: 115279-57-7 Catalog No: AG000GJT MDL No:MFCD09909912
Product Description
Catalog Number:
AG000GJT
Chemical Name:
Benzeneacetonitrile, 4-amino-α,α-dimethyl-
CAS Number:
115279-57-7
Molecular Formula:
C10H12N2
Molecular Weight:
160.2157
MDL Number:
MFCD09909912
IUPAC Name:
2-(4-aminophenyl)-2-methylpropanenitrile
InChI:
InChI=1S/C10H12N2/c1-10(2,7-11)8-3-5-9(12)6-4-8/h3-6H,12H2,1-2H3
InChI Key:
VXDPOGVDHHJTDY-UHFFFAOYSA-N
SMILES:
N#CC(c1ccc(cc1)N)(C)C
Properties
Complexity:
191
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
160.1g/mol
Formal Charge:
0
Heavy Atom Count:
12
Hydrogen Bond Acceptor Count:
2
Hydrogen Bond Donor Count:
1
Isotope Atom Count:
0
Molecular Weight:
160.22g/mol
Monoisotopic Mass:
160.1g/mol
Rotatable Bond Count:
1
Topological Polar Surface Area:
49.8A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
1.8
Literature
| Title | Journal |
|---|---|
| Role of channel activation in cognitive enhancement mediated by alpha7 nicotinic acetylcholine receptors. | British journal of pharmacology 20091101 |
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