Home Other Building Blocks (5-Chloro-1H-benzo[d]imidazol-2-yl)methanamine

(5-Chloro-1H-benzo[d]imidazol-2-yl)methanamine

CAS No.:
273399-95-4
Catalog Number:
AG0037FS
Molecular Formula:
C8H8ClN3
Molecular Weight:
181.6222
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Product Description
Catalog Number:
AG0037FS
Chemical Name:
(5-Chloro-1H-benzo[d]imidazol-2-yl)methanamine
CAS Number:
273399-95-4
Molecular Formula:
C8H8ClN3
Molecular Weight:
181.6222
MDL Number:
MFCD09038197
IUPAC Name:
(6-chloro-1H-benzimidazol-2-yl)methanamine
InChI:
InChI=1S/C8H8ClN3/c9-5-1-2-6-7(3-5)12-8(4-10)11-6/h1-3H,4,10H2,(H,11,12)
InChI Key:
WVBPEUGZSSDGPT-UHFFFAOYSA-N
SMILES:
NCc1nc2c([nH]1)ccc(c2)Cl
Properties
Complexity:
164  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
181.041g/mol
Formal Charge:
0
Heavy Atom Count:
12  
Hydrogen Bond Acceptor Count:
2  
Hydrogen Bond Donor Count:
2  
Isotope Atom Count:
0
Molecular Weight:
181.623g/mol
Monoisotopic Mass:
181.041g/mol
Rotatable Bond Count:
1  
Topological Polar Surface Area:
54.7A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
1.4  
Properties