Home Other Building Blocks 2-butyl-1H-1,3-benzodiazol-5-amine dihydrochloride

2-butyl-1H-1,3-benzodiazol-5-amine dihydrochloride

CAS No.:
1197821-90-1
Catalog Number:
AG019WMN
Molecular Formula:
C11H17Cl2N3
Molecular Weight:
262.1788
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Product Description
Catalog Number:
AG019WMN
Chemical Name:
2-butyl-1H-1,3-benzodiazol-5-amine dihydrochloride
CAS Number:
1197821-90-1
Molecular Formula:
C11H17Cl2N3
Molecular Weight:
262.1788
MDL Number:
MFCD12913107
IUPAC Name:
2-butyl-3H-benzimidazol-5-amine;dihydrochloride
InChI:
InChI=1S/C11H15N3.2ClH/c1-2-3-4-11-13-9-6-5-8(12)7-10(9)14-11;;/h5-7H,2-4,12H2,1H3,(H,13,14);2*1H
InChI Key:
VHCNSYJJLKZADN-UHFFFAOYSA-N
SMILES:
CCCCc1nc2c([nH]1)ccc(c2)N.Cl.Cl
Properties
Complexity:
183  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
3  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
261.08g/mol
Formal Charge:
0
Heavy Atom Count:
16  
Hydrogen Bond Acceptor Count:
2  
Hydrogen Bond Donor Count:
4  
Isotope Atom Count:
0
Molecular Weight:
262.178g/mol
Monoisotopic Mass:
261.08g/mol
Rotatable Bond Count:
3  
Topological Polar Surface Area:
54.7A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
Properties