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Home Nitriles 2-Methyl-2-(phenylamino);propanenitrile

2-Methyl-2-(phenylamino);propanenitrile

CAS No.:
2182-38-9
Catalog Number:
AG007P34
Molecular Formula:
C10H12N2
Molecular Weight:
160.2157
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Product Description
Catalog Number:
AG007P34
Chemical Name:
2-Methyl-2-(phenylamino);propanenitrile
CAS Number:
2182-38-9
Molecular Formula:
C10H12N2
Molecular Weight:
160.2157
MDL Number:
MFCD00035943
IUPAC Name:
2-anilino-2-methylpropanenitrile
InChI:
InChI=1S/C10H12N2/c1-10(2,8-11)12-9-6-4-3-5-7-9/h3-7,12H,1-2H3
InChI Key:
NCTOGJVAFQWQOR-UHFFFAOYSA-N
SMILES:
N#CC(Nc1ccccc1)(C)C
EC Number:
218-559-6
NSC Number:
153837
Properties
Complexity:
181  
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:
2  
Topological Polar Surface Area:
35.8A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
2.3  
Literature
Title Journal
Synthesis and SAR studies of 1,4-benzoxazine MenB inhibitors: novel antibacterial agents against Mycobacterium tuberculosis. Bioorganic & medicinal chemistry letters 20101101
Microsphere-based protease assays and screening application for lethal factor and factor Xa. Cytometry. Part A : the journal of the International Society for Analytical Cytology 20060501
Properties