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80881-48-7 | 5(2H)-Thiazolone, 2-ethyl-2-methyl-, oxime
CAS No: 80881-48-7 Catalog No: AG005IAO MDL No:
Product Description
Catalog Number:
AG005IAO
Chemical Name:
5(2H)-Thiazolone, 2-ethyl-2-methyl-, oxime
CAS Number:
80881-48-7
Molecular Formula:
C6H10N2OS
Molecular Weight:
158.2214
IUPAC Name:
N-(2-ethyl-2-methyl-1,3-thiazol-5-ylidene)hydroxylamine
InChI:
InChI=1S/C6H10N2OS/c1-3-6(2)7-4-5(8-9)10-6/h4,9H,3H2,1-2H3
InChI Key:
XQHWWMSCEHWWIS-UHFFFAOYSA-N
SMILES:
CC1(CC)SC(=NO)C=N1
Properties
Complexity:
190
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
158.051g/mol
Formal Charge:
0
Heavy Atom Count:
10
Hydrogen Bond Acceptor Count:
4
Hydrogen Bond Donor Count:
1
Isotope Atom Count:
0
Molecular Weight:
158.219g/mol
Monoisotopic Mass:
158.051g/mol
Rotatable Bond Count:
1
Topological Polar Surface Area:
70.2A^2
Undefined Atom Stereocenter Count:
1
Undefined Bond Stereocenter Count:
1
XLogP3:
1.7
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