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Home Other Building Blocks 2-(Trifluoromethyl)-1h-benzimidazol-5-amine dihydrochloride

2-(Trifluoromethyl)-1h-benzimidazol-5-amine dihydrochloride

CAS No.:
3671-66-7
Catalog Number:
AG003MCZ
Molecular Formula:
C8H6F3N3
Molecular Weight:
201.1485
Pack Size
Purity
Availability
Location
Price(USD)
Quantity
  
1g
≥ 95% (NMR)
1 week
United States
$89
- +
5g
≥ 95% (NMR)
1 week
United States
$221
- +
25g
≥ 95% (NMR)
1 week
United States
$901
- +
Product Description
Catalog Number:
AG003MCZ
Chemical Name:
2-(Trifluoromethyl)-1h-benzimidazol-5-amine dihydrochloride
CAS Number:
3671-66-7
Molecular Formula:
C8H6F3N3
Molecular Weight:
201.1485
MDL Number:
MFCD01632182
IUPAC Name:
2-(trifluoromethyl)-3H-benzimidazol-5-amine
InChI:
InChI=1S/C8H6F3N3/c9-8(10,11)7-13-5-2-1-4(12)3-6(5)14-7/h1-3H,12H2,(H,13,14)
InChI Key:
CKEKFQLHCAZGSP-UHFFFAOYSA-N
SMILES:
Nc1ccc2c(c1)nc([nH]2)C(F)(F)F
Properties
Complexity:
218  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
201.051g/mol
Formal Charge:
0
Heavy Atom Count:
14  
Hydrogen Bond Acceptor Count:
5  
Hydrogen Bond Donor Count:
2  
Isotope Atom Count:
0
Molecular Weight:
201.152g/mol
Monoisotopic Mass:
201.051g/mol
Rotatable Bond Count:
0
Topological Polar Surface Area:
54.7A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
2.2  
Literature
Title Journal
Synthesis and SAR studies of 1,4-benzoxazine MenB inhibitors: novel antibacterial agents against Mycobacterium tuberculosis. Bioorganic & medicinal chemistry letters 20101101
Properties