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2060051-12-7 | 2-ethyl-5-formyl-N,N-dimethyl-1H-imidazole-1-sulfonamide
CAS No: 2060051-12-7 Catalog No: AG01BRK3 MDL No:MFCD30535769
Product Description
Catalog Number:
AG01BRK3
Chemical Name:
2-ethyl-5-formyl-N,N-dimethyl-1H-imidazole-1-sulfonamide
CAS Number:
2060051-12-7
Molecular Formula:
C8H13N3O3S
Molecular Weight:
231.2721
MDL Number:
MFCD30535769
IUPAC Name:
2-ethyl-5-formyl-N,N-dimethylimidazole-1-sulfonamide
InChI:
InChI=1S/C8H13N3O3S/c1-4-8-9-5-7(6-12)11(8)15(13,14)10(2)3/h5-6H,4H2,1-3H3
InChI Key:
HKSCPYHWJZLHGC-UHFFFAOYSA-N
SMILES:
CCc1ncc(n1S(=O)(=O)N(C)C)C=O
Properties
Complexity:
323
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
231.068g/mol
Formal Charge:
0
Heavy Atom Count:
15
Hydrogen Bond Acceptor Count:
5
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
231.27g/mol
Monoisotopic Mass:
231.068g/mol
Rotatable Bond Count:
4
Topological Polar Surface Area:
80.6A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
0.2
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