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161363-34-4

161363-34-4 | Benzenamine, 3-(difluoromethyl)-, hydrochloride (1:1)

CAS No: 161363-34-4 Catalog No: AG001SER MDL No:MFCD16547606

Product Description

Catalog Number:
AG001SER
Chemical Name:
Benzenamine, 3-(difluoromethyl)-, hydrochloride (1:1)
CAS Number:
161363-34-4
Molecular Formula:
C7H8ClF2N
Molecular Weight:
179.5949
MDL Number:
MFCD16547606
IUPAC Name:
3-(difluoromethyl)aniline;hydrochloride
InChI:
InChI=1S/C7H7F2N.ClH/c8-7(9)5-2-1-3-6(10)4-5;/h1-4,7H,10H2;1H
InChI Key:
OLXFMDJJSLZYLD-UHFFFAOYSA-N
SMILES:
Nc1cccc(c1)C(F)F.Cl

Properties

Complexity:
106  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
2  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
179.031g/mol
Formal Charge:
0
Heavy Atom Count:
11  
Hydrogen Bond Acceptor Count:
3  
Hydrogen Bond Donor Count:
2  
Isotope Atom Count:
0
Molecular Weight:
179.595g/mol
Monoisotopic Mass:
179.031g/mol
Rotatable Bond Count:
1  
Topological Polar Surface Area:
26A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0

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