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Mebendazole-d3

CAS No.:
1173021-87-8
Catalog Number:
AG008S6J
Molecular Formula:
Molecular Weight:
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Product Description
Catalog Number:
AG008S6J
Chemical Name:
Mebendazole-d3
CAS Number:
1173021-87-8
MDL Number:
MFCD16652557
IUPAC Name:
trideuteriomethyl N-(6-benzoyl-1H-benzimidazol-2-yl)carbamate
InChI:
InChI=1S/C16H13N3O3/c1-22-16(21)19-15-17-12-8-7-11(9-13(12)18-15)14(20)10-5-3-2-4-6-10/h2-9H,1H3,(H2,17,18,19,21)/i1D3
InChI Key:
OPXLLQIJSORQAM-FIBGUPNXSA-N
Properties
Complexity:
423  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
298.115g/mol
Formal Charge:
0
Heavy Atom Count:
22  
Hydrogen Bond Acceptor Count:
4  
Hydrogen Bond Donor Count:
2  
Isotope Atom Count:
3  
Molecular Weight:
298.316g/mol
Monoisotopic Mass:
298.115g/mol
Rotatable Bond Count:
4  
Topological Polar Surface Area:
84.1A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
2.8  
Properties