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239-12-3 | [1]Benzothiopyrano[4,3-b]indole(8CI,9CI)
CAS No: 239-12-3 Catalog No: AG007OFY MDL No:
Product Description
Catalog Number:
AG007OFY
Chemical Name:
[1]Benzothiopyrano[4,3-b]indole(8CI,9CI)
CAS Number:
239-12-3
Molecular Formula:
C15H9NS
Molecular Weight:
235.3037
IUPAC Name:
thiochromeno[4,3-b]indole
InChI:
InChI=1S/C15H9NS/c1-3-7-13-10(5-1)12-9-17-14-8-4-2-6-11(14)15(12)16-13/h1-9H
InChI Key:
LVRMUSVWQJOVKM-UHFFFAOYSA-N
SMILES:
c1ccc2c(c1)c1nc3c(c1cs2)cccc3
Properties
Complexity:
293
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
235.046g/mol
Formal Charge:
0
Heavy Atom Count:
17
Hydrogen Bond Acceptor Count:
2
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
235.304g/mol
Monoisotopic Mass:
235.046g/mol
Rotatable Bond Count:
0
Topological Polar Surface Area:
41.1A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
4.2
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