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89155-23-7 | 2-Selenophenesulfonic acid, 5-(1-methyl-1H-benzimidazol-2-yl)-
CAS No: 89155-23-7 Catalog No: AG006AIV MDL No:
Product Description
Catalog Number:
AG006AIV
Chemical Name:
2-Selenophenesulfonic acid, 5-(1-methyl-1H-benzimidazol-2-yl)-
CAS Number:
89155-23-7
Molecular Formula:
C12H10N2O3SSe
Molecular Weight:
341.2444
IUPAC Name:
5-(1-methylbenzimidazol-2-yl)selenophene-2-sulfonic acid
InChI:
InChI=1S/C12H10N2O3SSe/c1-14-9-5-3-2-4-8(9)13-12(14)10-6-7-11(19-10)18(15,16)17/h2-7H,1H3,(H,15,16,17)
InChI Key:
PAXLWRQRYALWOO-UHFFFAOYSA-N
SMILES:
Cn1c(nc2c1cccc2)c1ccc([se]1)S(=O)(=O)O
Properties
Complexity:
439
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
341.958g/mol
Formal Charge:
0
Heavy Atom Count:
19
Hydrogen Bond Acceptor Count:
4
Hydrogen Bond Donor Count:
1
Isotope Atom Count:
0
Molecular Weight:
341.254g/mol
Monoisotopic Mass:
341.958g/mol
Rotatable Bond Count:
2
Topological Polar Surface Area:
80.6A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
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