Home Other Building Blocks 2-[(2-fluorophenyl)methyl]-1H-1,3-benzodiazol-5-amine dihydrochloride

2-[(2-fluorophenyl)methyl]-1H-1,3-benzodiazol-5-amine dihydrochloride

CAS No.:
1172291-64-3
Catalog Number:
AG019V8X
Molecular Formula:
C14H14Cl2FN3
Molecular Weight:
314.1855
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Product Description
Catalog Number:
AG019V8X
Chemical Name:
2-[(2-fluorophenyl)methyl]-1H-1,3-benzodiazol-5-amine dihydrochloride
CAS Number:
1172291-64-3
Molecular Formula:
C14H14Cl2FN3
Molecular Weight:
314.1855
MDL Number:
MFCD12197075
IUPAC Name:
2-[(2-fluorophenyl)methyl]-3H-benzimidazol-5-amine;dihydrochloride
InChI:
InChI=1S/C14H12FN3.2ClH/c15-11-4-2-1-3-9(11)7-14-17-12-6-5-10(16)8-13(12)18-14;;/h1-6,8H,7,16H2,(H,17,18);2*1H
InChI Key:
VJBKNBFQJFMRBD-UHFFFAOYSA-N
SMILES:
Nc1ccc2c(c1)nc([nH]2)Cc1ccccc1F.Cl.Cl
Properties
Complexity:
286  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
3  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
313.055g/mol
Formal Charge:
0
Heavy Atom Count:
20  
Hydrogen Bond Acceptor Count:
3  
Hydrogen Bond Donor Count:
4  
Isotope Atom Count:
0
Molecular Weight:
314.185g/mol
Monoisotopic Mass:
313.055g/mol
Rotatable Bond Count:
2  
Topological Polar Surface Area:
54.7A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
Properties