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1468-84-4 | Benzo[b]thiophen-7(4H)-one, 5,6-dihydro-
CAS No: 1468-84-4 Catalog No: AG001ECL MDL No:MFCD01860756
Product Description
Catalog Number:
AG001ECL
Chemical Name:
Benzo[b]thiophen-7(4H)-one, 5,6-dihydro-
CAS Number:
1468-84-4
Molecular Formula:
C8H8OS
Molecular Weight:
152.2135
MDL Number:
MFCD01860756
IUPAC Name:
5,6-dihydro-4H-1-benzothiophen-7-one
InChI:
InChI=1S/C8H8OS/c9-7-3-1-2-6-4-5-10-8(6)7/h4-5H,1-3H2
InChI Key:
JEJQJCKVMQVOHZ-UHFFFAOYSA-N
SMILES:
O=C1CCCc2c1scc2
Properties
Complexity:
155
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
152.03g/mol
Formal Charge:
0
Heavy Atom Count:
10
Hydrogen Bond Acceptor Count:
2
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
152.211g/mol
Monoisotopic Mass:
152.03g/mol
Rotatable Bond Count:
0
Topological Polar Surface Area:
45.3A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
2
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