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80881-54-5 | 2H-1,4-Thiazin-2-one, 5,6-dihydro-3-methyl-, oxime
CAS No: 80881-54-5 Catalog No: AG005IAK MDL No:
Product Description
Catalog Number:
AG005IAK
Chemical Name:
2H-1,4-Thiazin-2-one, 5,6-dihydro-3-methyl-, oxime
CAS Number:
80881-54-5
Molecular Formula:
C5H8N2OS
Molecular Weight:
144.1948
IUPAC Name:
N-(5-methyl-2,3-dihydro-1,4-thiazin-6-ylidene)hydroxylamine
InChI:
InChI=1S/C5H8N2OS/c1-4-5(7-8)9-3-2-6-4/h8H,2-3H2,1H3
InChI Key:
GODMMJRZJGBZSA-UHFFFAOYSA-N
SMILES:
ON=C1SCCN=C1C
Properties
Complexity:
164
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
144.036g/mol
Formal Charge:
0
Heavy Atom Count:
9
Hydrogen Bond Acceptor Count:
4
Hydrogen Bond Donor Count:
1
Isotope Atom Count:
0
Molecular Weight:
144.192g/mol
Monoisotopic Mass:
144.036g/mol
Rotatable Bond Count:
0
Topological Polar Surface Area:
70.2A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
1
XLogP3:
0.5
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