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Home > Imidazoles > 82130-71-0
82130-71-0 | methyl N-[5-(2-methylpropylsulfinyl)-3H-benzoimidazol-2-yl]carbamate
CAS No: 82130-71-0 Catalog No: AG00GJSS MDL No:
Product Description
Catalog Number:
AG00GJSS
Chemical Name:
methyl N-[5-(2-methylpropylsulfinyl)-3H-benzoimidazol-2-yl]carbamate
CAS Number:
82130-71-0
IUPAC Name:
methyl N-[6-(2-methylpropylsulfinyl)-1H-benzimidazol-2-yl]carbamate;hydrochloride
InChI:
InChI=1S/C13H17N3O3S.ClH/c1-8(2)7-20(18)9-4-5-10-11(6-9)15-12(14-10)16-13(17)19-3;/h4-6,8H,7H2,1-3H3,(H2,14,15,16,17);1H
InChI Key:
KUEBVYBKHLDKNF-UHFFFAOYSA-N
Properties
Complexity:
378
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
2
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
331.076g/mol
Formal Charge:
0
Heavy Atom Count:
21
Hydrogen Bond Acceptor Count:
5
Hydrogen Bond Donor Count:
3
Isotope Atom Count:
0
Molecular Weight:
331.815g/mol
Monoisotopic Mass:
331.076g/mol
Rotatable Bond Count:
5
Topological Polar Surface Area:
103A^2
Undefined Atom Stereocenter Count:
1
Undefined Bond Stereocenter Count:
0
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