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67580-40-9 | 4H-Furo[3,4-d][1,3]thiazin-7(5H)-one
CAS No: 67580-40-9 Catalog No: AG005M96 MDL No:
Product Description
Catalog Number:
AG005M96
Chemical Name:
4H-Furo[3,4-d][1,3]thiazin-7(5H)-one
CAS Number:
67580-40-9
Molecular Formula:
C6H5NO2S
Molecular Weight:
155.1744
IUPAC Name:
4,5-dihydrofuro[3,4-d][1,3]thiazin-7-one
InChI:
InChI=1S/C6H5NO2S/c8-6-5-4(1-9-6)2-10-3-7-5/h3H,1-2H2
InChI Key:
KCYLNIRDDVKDRK-UHFFFAOYSA-N
SMILES:
O=C1OCC2=C1N=CSC2
Properties
Complexity:
244
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
155.004g/mol
Formal Charge:
0
Heavy Atom Count:
10
Hydrogen Bond Acceptor Count:
4
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
155.171g/mol
Monoisotopic Mass:
155.004g/mol
Rotatable Bond Count:
0
Topological Polar Surface Area:
64A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
-0.1
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