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Home > Imidazoles > 886493-06-7
886493-06-7 | Spiro[2H-benzimidazole-2,3'-[3H]pyrrole](9CI)
CAS No: 886493-06-7 Catalog No: AG0048YH MDL No:MFCD27957537
Product Description
Catalog Number:
AG0048YH
Chemical Name:
Spiro[2H-benzimidazole-2,3'-[3H]pyrrole](9CI)
CAS Number:
886493-06-7
Molecular Formula:
C10H7N3
Molecular Weight:
169.1827
MDL Number:
MFCD27957537
IUPAC Name:
spiro[benzimidazole-2,3'-pyrrole]
InChI:
InChI=1S/C10H7N3/c1-2-4-9-8(3-1)12-10(13-9)5-6-11-7-10/h1-7H
InChI Key:
YHYLNKQJEWNFLI-UHFFFAOYSA-N
SMILES:
C1=CC2(C=N1)N=c1c(=N2)cccc1
Properties
Complexity:
405
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
169.064g/mol
Formal Charge:
0
Heavy Atom Count:
13
Hydrogen Bond Acceptor Count:
3
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
169.187g/mol
Monoisotopic Mass:
169.064g/mol
Rotatable Bond Count:
0
Topological Polar Surface Area:
37.1A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
0
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