Home Other Building Blocks methyl({[5-(trifluoromethyl)-1H-1,3-benzodiazol-2-yl]methyl})amine dihydrochloride

methyl({[5-(trifluoromethyl)-1H-1,3-benzodiazol-2-yl]methyl})amine dihydrochloride

CAS No.:
1632257-96-5
Catalog Number:
AG01B5CT
Molecular Formula:
C10H12Cl2F3N3
Molecular Weight:
302.1236
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Product Description
Catalog Number:
AG01B5CT
Chemical Name:
methyl({[5-(trifluoromethyl)-1H-1,3-benzodiazol-2-yl]methyl})amine dihydrochloride
CAS Number:
1632257-96-5
Molecular Formula:
C10H12Cl2F3N3
Molecular Weight:
302.1236
MDL Number:
MFCD29992003
IUPAC Name:
N-methyl-1-[6-(trifluoromethyl)-1H-benzimidazol-2-yl]methanamine;dihydrochloride
InChI:
InChI=1S/C10H10F3N3.2ClH/c1-14-5-9-15-7-3-2-6(10(11,12)13)4-8(7)16-9;;/h2-4,14H,5H2,1H3,(H,15,16);2*1H
InChI Key:
YEBNIAJIDNWVSU-UHFFFAOYSA-N
SMILES:
CNCc1nc2c([nH]1)ccc(c2)C(F)(F)F.Cl.Cl
Properties
Complexity:
244  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
3  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
301.036g/mol
Formal Charge:
0
Heavy Atom Count:
18  
Hydrogen Bond Acceptor Count:
5  
Hydrogen Bond Donor Count:
4  
Isotope Atom Count:
0
Molecular Weight:
302.122g/mol
Monoisotopic Mass:
301.036g/mol
Rotatable Bond Count:
2  
Topological Polar Surface Area:
40.7A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
Properties