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37572-35-3 | N-Ethyl-3,5-bis(methylthio)-4-isothiazolecarboxamide
CAS No: 37572-35-3 Catalog No: AG00D344 MDL No:
Product Description
Catalog Number:
AG00D344
Chemical Name:
N-Ethyl-3,5-bis(methylthio)-4-isothiazolecarboxamide
CAS Number:
37572-35-3
IUPAC Name:
N-ethyl-3,5-bis(methylsulfanyl)-1,2-thiazole-4-carboxamide
InChI:
InChI=1S/C8H12N2OS3/c1-4-9-6(11)5-7(12-2)10-14-8(5)13-3/h4H2,1-3H3,(H,9,11)
InChI Key:
DNPFXCKPTYVATJ-UHFFFAOYSA-N
Properties
Complexity:
203
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
248.011g/mol
Formal Charge:
0
Heavy Atom Count:
14
Hydrogen Bond Acceptor Count:
5
Hydrogen Bond Donor Count:
1
Isotope Atom Count:
0
Molecular Weight:
248.377g/mol
Monoisotopic Mass:
248.011g/mol
Rotatable Bond Count:
4
Topological Polar Surface Area:
121A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
2.3
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