Home Other Building Blocks 5-(trifluoromethyl)-1H-1,3-benzodiazol-2-amine hydrochloride

5-(trifluoromethyl)-1H-1,3-benzodiazol-2-amine hydrochloride

CAS No.:
1423033-54-8
Catalog Number:
AG01A1UN
Molecular Formula:
C8H7ClF3N3
Molecular Weight:
237.6095
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Product Description
Catalog Number:
AG01A1UN
Chemical Name:
5-(trifluoromethyl)-1H-1,3-benzodiazol-2-amine hydrochloride
CAS Number:
1423033-54-8
Molecular Formula:
C8H7ClF3N3
Molecular Weight:
237.6095
MDL Number:
MFCD22565955
IUPAC Name:
6-(trifluoromethyl)-1H-benzimidazol-2-amine;hydrochloride
InChI:
InChI=1S/C8H6F3N3.ClH/c9-8(10,11)4-1-2-5-6(3-4)14-7(12)13-5;/h1-3H,(H3,12,13,14);1H
InChI Key:
PTJJIMFXQHLHNJ-UHFFFAOYSA-N
SMILES:
Nc1[nH]c2c(n1)cc(cc2)C(F)(F)F.Cl
Properties
Complexity:
218  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
2  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
237.028g/mol
Formal Charge:
0
Heavy Atom Count:
15  
Hydrogen Bond Acceptor Count:
5  
Hydrogen Bond Donor Count:
3  
Isotope Atom Count:
0
Molecular Weight:
237.61g/mol
Monoisotopic Mass:
237.028g/mol
Rotatable Bond Count:
0
Topological Polar Surface Area:
54.7A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
Properties