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120161-06-0 | 1H-Benzimidazole,2-(1-pyrrolidinyl)-(9CI)
CAS No: 120161-06-0 Catalog No: AG008VGV MDL No:MFCD08277409
Product Description
Catalog Number:
AG008VGV
Chemical Name:
1H-Benzimidazole,2-(1-pyrrolidinyl)-(9CI)
CAS Number:
120161-06-0
Molecular Formula:
C11H13N3
Molecular Weight:
187.2410
MDL Number:
MFCD08277409
IUPAC Name:
2-pyrrolidin-1-yl-1H-benzimidazole
InChI:
InChI=1S/C11H13N3/c1-2-6-10-9(5-1)12-11(13-10)14-7-3-4-8-14/h1-2,5-6H,3-4,7-8H2,(H,12,13)
InChI Key:
RXWCRIKVVODMRG-UHFFFAOYSA-N
SMILES:
C1CCN(C1)c1nc2c([nH]1)cccc2
Properties
Complexity:
201
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
187.111g/mol
Formal Charge:
0
Heavy Atom Count:
14
Hydrogen Bond Acceptor Count:
2
Hydrogen Bond Donor Count:
1
Isotope Atom Count:
0
Molecular Weight:
187.246g/mol
Monoisotopic Mass:
187.111g/mol
Rotatable Bond Count:
1
Topological Polar Surface Area:
31.9A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
2.2
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