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80881-52-3 | 5(2H)-Thiazolone, 2,2-diethyl-4-methyl-, oxime
CAS No: 80881-52-3 Catalog No: AG008LMH MDL No:
Product Description
Catalog Number:
AG008LMH
Chemical Name:
5(2H)-Thiazolone, 2,2-diethyl-4-methyl-, oxime
CAS Number:
80881-52-3
Molecular Formula:
C8H14N2OS
Molecular Weight:
186.2746
IUPAC Name:
N-(2,2-diethyl-4-methyl-1,3-thiazol-5-ylidene)hydroxylamine
InChI:
InChI=1S/C8H14N2OS/c1-4-8(5-2)9-6(3)7(10-11)12-8/h11H,4-5H2,1-3H3
InChI Key:
HUYDJTZCJLUSTB-UHFFFAOYSA-N
SMILES:
ON=C1SC(N=C1C)(CC)CC
Properties
Complexity:
231
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
186.083g/mol
Formal Charge:
0
Heavy Atom Count:
12
Hydrogen Bond Acceptor Count:
4
Hydrogen Bond Donor Count:
1
Isotope Atom Count:
0
Molecular Weight:
186.273g/mol
Monoisotopic Mass:
186.083g/mol
Rotatable Bond Count:
2
Topological Polar Surface Area:
70.2A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
1
XLogP3:
2.2
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