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903587-98-4 | 2,2,2-Trichloroethoxysulfuryl Imidazole
CAS No: 903587-98-4 Catalog No: AG003F6S MDL No:
Product Description
Catalog Number:
AG003F6S
Chemical Name:
2,2,2-Trichloroethoxysulfuryl Imidazole
CAS Number:
903587-98-4
IUPAC Name:
2,2,2-trichloroethyl 1H-imidazole-2-sulfonate
InChI:
InChI=1S/C5H5Cl3N2O3S/c6-5(7,8)3-13-14(11,12)4-9-1-2-10-4/h1-2H,3H2,(H,9,10)
InChI Key:
DCLRQEGHGBFLAQ-UHFFFAOYSA-N
Properties
Complexity:
284
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
277.909g/mol
Formal Charge:
0
Heavy Atom Count:
14
Hydrogen Bond Acceptor Count:
4
Hydrogen Bond Donor Count:
1
Isotope Atom Count:
0
Molecular Weight:
279.516g/mol
Monoisotopic Mass:
277.909g/mol
Rotatable Bond Count:
3
Topological Polar Surface Area:
80.4A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
1.5
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