Home Nitriles 2-[(4-fluoro-2-methylphenyl)amino]acetonitrile

2-[(4-fluoro-2-methylphenyl)amino]acetonitrile

CAS No.:
1021233-24-8
Catalog Number:
AG01BVLL
Molecular Formula:
C9H9FN2
Molecular Weight:
164.1796
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Product Description
Catalog Number:
AG01BVLL
Chemical Name:
2-[(4-fluoro-2-methylphenyl)amino]acetonitrile
CAS Number:
1021233-24-8
Molecular Formula:
C9H9FN2
Molecular Weight:
164.1796
MDL Number:
MFCD11153945
IUPAC Name:
2-(4-fluoro-2-methylanilino)acetonitrile
InChI:
InChI=1S/C9H9FN2/c1-7-6-8(10)2-3-9(7)12-5-4-11/h2-3,6,12H,5H2,1H3
InChI Key:
HRHZXNDHVJHQRF-UHFFFAOYSA-N
SMILES:
N#CCNc1ccc(cc1C)F
Properties
Complexity:
184  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
164.075g/mol
Formal Charge:
0
Heavy Atom Count:
12  
Hydrogen Bond Acceptor Count:
3  
Hydrogen Bond Donor Count:
1  
Isotope Atom Count:
0
Molecular Weight:
164.183g/mol
Monoisotopic Mass:
164.075g/mol
Rotatable Bond Count:
2  
Topological Polar Surface Area:
35.8A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
2.2  
Properties