Home Aminos 2-Propanol,1-(1H-benzimidazol-2-ylamino)-(9CI)

2-Propanol,1-(1H-benzimidazol-2-ylamino)-(9CI)

CAS No.:
120161-07-1
Catalog Number:
AG0098P8
Molecular Formula:
C10H13N3O
Molecular Weight:
191.2297
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Product Description
Catalog Number:
AG0098P8
Chemical Name:
2-Propanol,1-(1H-benzimidazol-2-ylamino)-(9CI)
CAS Number:
120161-07-1
Molecular Formula:
C10H13N3O
Molecular Weight:
191.2297
MDL Number:
MFCD03966903
IUPAC Name:
1-(1H-benzimidazol-2-ylamino)propan-2-ol
InChI:
InChI=1S/C10H13N3O/c1-7(14)6-11-10-12-8-4-2-3-5-9(8)13-10/h2-5,7,14H,6H2,1H3,(H2,11,12,13)
InChI Key:
PSVRXGARSFQENR-UHFFFAOYSA-N
SMILES:
CC(CNc1nc2c([nH]1)cccc2)O
Properties
Complexity:
188  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
191.106g/mol
Formal Charge:
0
Heavy Atom Count:
14  
Hydrogen Bond Acceptor Count:
3  
Hydrogen Bond Donor Count:
3  
Isotope Atom Count:
0
Molecular Weight:
191.234g/mol
Monoisotopic Mass:
191.106g/mol
Rotatable Bond Count:
3  
Topological Polar Surface Area:
60.9A^2
Undefined Atom Stereocenter Count:
1  
Undefined Bond Stereocenter Count:
0
XLogP3:
1.3  
Properties