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Home > Imidazoles > 1123-97-3
1123-97-3 | 2H-Benzimidazol-2-one,octahydro-
CAS No: 1123-97-3 Catalog No: AG0082O1 MDL No:
Product Description
Catalog Number:
AG0082O1
Chemical Name:
2H-Benzimidazol-2-one,octahydro-
CAS Number:
1123-97-3
Molecular Formula:
C7H12N2O
Molecular Weight:
140.1830
IUPAC Name:
1,3,3a,4,5,6,7,7a-octahydrobenzimidazol-2-one
InChI:
InChI=1S/C7H12N2O/c10-7-8-5-3-1-2-4-6(5)9-7/h5-6H,1-4H2,(H2,8,9,10)
InChI Key:
RWIIUBCMPVZLBA-UHFFFAOYSA-N
SMILES:
O=C1N[C@@H]2[C@H](N1)CCCC2
Properties
Complexity:
142
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
140.095g/mol
Formal Charge:
0
Heavy Atom Count:
10
Hydrogen Bond Acceptor Count:
1
Hydrogen Bond Donor Count:
2
Isotope Atom Count:
0
Molecular Weight:
140.186g/mol
Monoisotopic Mass:
140.095g/mol
Rotatable Bond Count:
0
Topological Polar Surface Area:
41.1A^2
Undefined Atom Stereocenter Count:
2
Undefined Bond Stereocenter Count:
0
XLogP3:
0.5
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