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22232-54-8

22232-54-8 | Carbimazole

CAS No: 22232-54-8 Catalog No: AG003OP9 MDL No:MFCD00027421

Product Description

Catalog Number:
AG003OP9
Chemical Name:
Carbimazole
CAS Number:
22232-54-8
Molecular Formula:
C7H10N2O2S
Molecular Weight:
186.2315
MDL Number:
MFCD00027421
IUPAC Name:
ethyl 3-methyl-2-sulfanylideneimidazole-1-carboxylate
InChI:
InChI=1S/C7H10N2O2S/c1-3-11-7(10)9-5-4-8(2)6(9)12/h4-5H,3H2,1-2H3
InChI Key:
CFOYWRHIYXMDOT-UHFFFAOYSA-N
SMILES:
CCOC(=O)n1ccn(c1=S)C
EC Number:
244-854-4
UNII:
8KQ660G60G
NSC Number:
758966

Properties

Complexity:
240  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
186.046g/mol
Formal Charge:
0
Heavy Atom Count:
12  
Hydrogen Bond Acceptor Count:
3  
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
186.229g/mol
Monoisotopic Mass:
186.046g/mol
Rotatable Bond Count:
2  
Topological Polar Surface Area:
64.9A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
0.7  

Literature

Title Journal
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The evolving role of selenium in the treatment of graves' disease and ophthalmopathy. Journal of thyroid research 20120101
Bone mineral density in patients of Graves disease pre- & post-treatment in a predominantly vitamin D deficient population. The Indian journal of medical research 20120101
Interactions between thyroid disorders and kidney disease. Indian journal of endocrinology and metabolism 20120101
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