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85559-16-6 | 6H-1,3-Thiazine, 2-ethoxy-5-methyl-
CAS No: 85559-16-6 Catalog No: AG004R2J MDL No:
Product Description
Catalog Number:
AG004R2J
Chemical Name:
6H-1,3-Thiazine, 2-ethoxy-5-methyl-
CAS Number:
85559-16-6
Molecular Formula:
C7H11NOS
Molecular Weight:
157.2333
IUPAC Name:
2-ethoxy-5-methyl-6H-1,3-thiazine
InChI:
InChI=1S/C7H11NOS/c1-3-9-7-8-4-6(2)5-10-7/h4H,3,5H2,1-2H3
InChI Key:
IFDAGLBAPWQAMW-UHFFFAOYSA-N
SMILES:
CCOC1=NC=C(CS1)C
Properties
Complexity:
174
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
157.056g/mol
Formal Charge:
0
Heavy Atom Count:
10
Hydrogen Bond Acceptor Count:
3
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
157.231g/mol
Monoisotopic Mass:
157.056g/mol
Rotatable Bond Count:
2
Topological Polar Surface Area:
46.9A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
1.4
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