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68158-16-7 | Ethanone, 1-(4-thiazolyl)-, oxime (9CI)
CAS No: 68158-16-7 Catalog No: AG00FO2B MDL No:MFCD03550489
Product Description
Catalog Number:
AG00FO2B
Chemical Name:
Ethanone, 1-(4-thiazolyl)-, oxime (9CI)
CAS Number:
68158-16-7
Molecular Formula:
C5H6N2OS
Molecular Weight:
142.1789
MDL Number:
MFCD03550489
IUPAC Name:
(NZ)-N-[1-(1,3-thiazol-4-yl)ethylidene]hydroxylamine
InChI:
InChI=1S/C5H6N2OS/c1-4(7-8)5-2-9-3-6-5/h2-3,8H,1H3/b7-4-
InChI Key:
YFQLOVCNGQOSHY-DAXSKMNVSA-N
SMILES:
C/C(=N/O)/c1cscn1
Properties
Complexity:
126
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
1
Exact Mass:
142.02g/mol
Formal Charge:
0
Heavy Atom Count:
9
Hydrogen Bond Acceptor Count:
4
Hydrogen Bond Donor Count:
1
Isotope Atom Count:
0
Molecular Weight:
142.176g/mol
Monoisotopic Mass:
142.02g/mol
Rotatable Bond Count:
1
Topological Polar Surface Area:
73.7A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
1.2
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