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23134-34-1 | [1]Benzothieno[2,3-g]isoquinoline (8CI,9CI)
CAS No: 23134-34-1 Catalog No: AG002MAF MDL No:
Product Description
Catalog Number:
AG002MAF
Chemical Name:
[1]Benzothieno[2,3-g]isoquinoline (8CI,9CI)
CAS Number:
23134-34-1
Molecular Formula:
C15H9NS
Molecular Weight:
235.3037
IUPAC Name:
[1]benzothiolo[2,3-g]isoquinoline
InChI:
InChI=1S/C15H9NS/c1-2-4-14-12(3-1)13-7-11-9-16-6-5-10(11)8-15(13)17-14/h1-9H
InChI Key:
IRZQXMAQSQQBSJ-UHFFFAOYSA-N
SMILES:
c1ncc2c(c1)cc1c(c2)c2c(s1)cccc2
NSC Number:
126317
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:
4.5
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