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243-04-9 | Benzofuro[2,3-f]benzothiazole(8CI,9CI)
CAS No: 243-04-9 Catalog No: AG006WKN MDL No:
Product Description
Catalog Number:
AG006WKN
Chemical Name:
Benzofuro[2,3-f]benzothiazole(8CI,9CI)
CAS Number:
243-04-9
Molecular Formula:
C13H7NOS
Molecular Weight:
225.2658
IUPAC Name:
[1]benzofuro[2,3-f][1,3]benzothiazole
InChI:
InChI=1S/C13H7NOS/c1-2-4-11-8(3-1)9-5-13-10(14-7-16-13)6-12(9)15-11/h1-7H
InChI Key:
CNKBDBFBPFCRRO-UHFFFAOYSA-N
SMILES:
c1ccc2c(c1)oc1c2cc2c(c1)ncs2
Properties
Complexity:
285
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
225.025g/mol
Formal Charge:
0
Heavy Atom Count:
16
Hydrogen Bond Acceptor Count:
3
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
225.265g/mol
Monoisotopic Mass:
225.025g/mol
Rotatable Bond Count:
0
Topological Polar Surface Area:
54.3A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
4.1
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