Home Other Building Blocks (5-fluoro-1-methyl-1H-1,3-benzodiazol-2-yl)methanamine dihydrochloride

(5-fluoro-1-methyl-1H-1,3-benzodiazol-2-yl)methanamine dihydrochloride

CAS No.:
1311314-23-4
Catalog Number:
AG01AH61
Molecular Formula:
C9H12Cl2FN3
Molecular Weight:
252.1161
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Product Description
Catalog Number:
AG01AH61
Chemical Name:
(5-fluoro-1-methyl-1H-1,3-benzodiazol-2-yl)methanamine dihydrochloride
CAS Number:
1311314-23-4
Molecular Formula:
C9H12Cl2FN3
Molecular Weight:
252.1161
MDL Number:
MFCD18483215
IUPAC Name:
(5-fluoro-1-methylbenzimidazol-2-yl)methanamine;dihydrochloride
InChI:
InChI=1S/C9H10FN3.2ClH/c1-13-8-3-2-6(10)4-7(8)12-9(13)5-11;;/h2-4H,5,11H2,1H3;2*1H
InChI Key:
ATRLZXNWGHTKHC-UHFFFAOYSA-N
SMILES:
NCc1nc2c(n1C)ccc(c2)F.Cl.Cl
Properties
Complexity:
188  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
3  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
251.039g/mol
Formal Charge:
0
Heavy Atom Count:
15  
Hydrogen Bond Acceptor Count:
3  
Hydrogen Bond Donor Count:
3  
Isotope Atom Count:
0
Molecular Weight:
252.114g/mol
Monoisotopic Mass:
251.039g/mol
Rotatable Bond Count:
1  
Topological Polar Surface Area:
43.8A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
Properties