Home Nitriles 5-amino-2-(difluoromethoxy)benzonitrile hydrochloride

5-amino-2-(difluoromethoxy)benzonitrile hydrochloride

CAS No.:
1803606-66-7
Catalog Number:
AG01BD2Z
Molecular Formula:
C8H7ClF2N2O
Molecular Weight:
220.6038
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Product Description
Catalog Number:
AG01BD2Z
Chemical Name:
5-amino-2-(difluoromethoxy)benzonitrile hydrochloride
CAS Number:
1803606-66-7
Molecular Formula:
C8H7ClF2N2O
Molecular Weight:
220.6038
MDL Number:
MFCD28012395
IUPAC Name:
5-amino-2-(difluoromethoxy)benzonitrile;hydrochloride
InChI:
InChI=1S/C8H6F2N2O.ClH/c9-8(10)13-7-2-1-6(12)3-5(7)4-11;/h1-3,8H,12H2;1H
InChI Key:
BIPZEPWBKCOVGZ-UHFFFAOYSA-N
SMILES:
N#Cc1cc(N)ccc1OC(F)F.Cl
Properties
Complexity:
213  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
2  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
220.021g/mol
Formal Charge:
0
Heavy Atom Count:
14  
Hydrogen Bond Acceptor Count:
5  
Hydrogen Bond Donor Count:
2  
Isotope Atom Count:
0
Molecular Weight:
220.604g/mol
Monoisotopic Mass:
220.021g/mol
Rotatable Bond Count:
2  
Topological Polar Surface Area:
59A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
Properties