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403848-56-6 | 5H-Pyrrolo[3,2-f]benzothiazole-6,7-dione(9CI)
CAS No: 403848-56-6 Catalog No: AG00CXZ9 MDL No:
Product Description
Catalog Number:
AG00CXZ9
Chemical Name:
5H-Pyrrolo[3,2-f]benzothiazole-6,7-dione(9CI)
CAS Number:
403848-56-6
IUPAC Name:
5H-pyrrolo[3,2-f][1,3]benzothiazole-6,7-dione
InChI:
InChI=1S/C9H4N2O2S/c12-8-4-1-6-7(14-3-10-6)2-5(4)11-9(8)13/h1-3H,(H,11,12,13)
InChI Key:
YIMVMGYYLCHYHD-UHFFFAOYSA-N
Properties
Complexity:
307
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
203.999g/mol
Formal Charge:
0
Heavy Atom Count:
14
Hydrogen Bond Acceptor Count:
4
Hydrogen Bond Donor Count:
1
Isotope Atom Count:
0
Molecular Weight:
204.203g/mol
Monoisotopic Mass:
203.999g/mol
Rotatable Bond Count:
0
Topological Polar Surface Area:
87.3A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
1.2
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