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24963-99-3 | Benzo[b]naphtho[2,3-d]thiophen-7(8H)-one, 9,10-dihydro-6-methyl-
CAS No: 24963-99-3 Catalog No: AG002Q00 MDL No:
Product Description
Catalog Number:
AG002Q00
Chemical Name:
Benzo[b]naphtho[2,3-d]thiophen-7(8H)-one, 9,10-dihydro-6-methyl-
CAS Number:
24963-99-3
Molecular Formula:
C17H14OS
Molecular Weight:
266.3575
IUPAC Name:
6-methyl-9,10-dihydro-8H-naphtho[7,6-b][1]benzothiol-7-one
InChI:
InChI=1S/C17H14OS/c1-10-16-11(5-4-7-14(16)18)9-13-12-6-2-3-8-15(12)19-17(10)13/h2-3,6,8-9H,4-5,7H2,1H3
InChI Key:
LATBWFJFINKWSA-UHFFFAOYSA-N
SMILES:
O=C1CCCc2c1c(C)c1c(c2)c2c(s1)cccc2
Properties
Complexity:
380
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
266.077g/mol
Formal Charge:
0
Heavy Atom Count:
19
Hydrogen Bond Acceptor Count:
2
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
266.358g/mol
Monoisotopic Mass:
266.077g/mol
Rotatable Bond Count:
0
Topological Polar Surface Area:
45.3A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
4.7
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