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1011361-15-1

1011361-15-1 | 4-(5-Amino-1-methyl-1H-benzoimidazol-2-yl)-butan-2-ol

CAS No: 1011361-15-1 Catalog No: AG01F853 MDL No:

Product Description

Catalog Number:
AG01F853
Chemical Name:
4-(5-Amino-1-methyl-1H-benzoimidazol-2-yl)-butan-2-ol
CAS Number:
1011361-15-1
Molecular Formula:
C12H17N3O
Molecular Weight:
219.2829
IUPAC Name:
4-(5-amino-1-methylbenzimidazol-2-yl)butan-2-ol
InChI:
InChI=1S/C12H17N3O/c1-8(16)3-6-12-14-10-7-9(13)4-5-11(10)15(12)2/h4-5,7-8,16H,3,6,13H2,1-2H3
InChI Key:
WZUSJACFSYAJSQ-UHFFFAOYSA-N
SMILES:
CC(CCc1nc2c(n1C)ccc(c2)N)O

Properties

Complexity:
236  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
219.137g/mol
Formal Charge:
0
Heavy Atom Count:
16  
Hydrogen Bond Acceptor Count:
3  
Hydrogen Bond Donor Count:
2  
Isotope Atom Count:
0
Molecular Weight:
219.288g/mol
Monoisotopic Mass:
219.137g/mol
Rotatable Bond Count:
3  
Topological Polar Surface Area:
64.1A^2
Undefined Atom Stereocenter Count:
1  
Undefined Bond Stereocenter Count:
0
XLogP3:
1.2  

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