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65200-35-3 | Cyclopenta[e]-1,3-thiazine-2,4(3H,5H)-dione, 6,7-dihydro-
CAS No: 65200-35-3 Catalog No: AG00H70J MDL No:
Product Description
Catalog Number:
AG00H70J
Chemical Name:
Cyclopenta[e]-1,3-thiazine-2,4(3H,5H)-dione, 6,7-dihydro-
CAS Number:
65200-35-3
Molecular Formula:
C7H7NO2S
Molecular Weight:
169.2010
IUPAC Name:
6,7-dihydro-5H-cyclopenta[e][1,3]thiazine-2,4-dione
InChI:
InChI=1S/C7H7NO2S/c9-6-4-2-1-3-5(4)11-7(10)8-6/h1-3H2,(H,8,9,10)
InChI Key:
KLYYJINLOUFDRT-UHFFFAOYSA-N
SMILES:
O=c1sc2CCCc2c(=O)[nH]1
Properties
Complexity:
270
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
169.02g/mol
Formal Charge:
0
Heavy Atom Count:
11
Hydrogen Bond Acceptor Count:
3
Hydrogen Bond Donor Count:
1
Isotope Atom Count:
0
Molecular Weight:
169.198g/mol
Monoisotopic Mass:
169.02g/mol
Rotatable Bond Count:
0
Topological Polar Surface Area:
71.5A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
0.8
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