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30415-24-8 | 7H-Phenaleno[1,2-c]thiophen-7-one
CAS No: 30415-24-8 Catalog No: AG00301R MDL No:
Product Description
Catalog Number:
AG00301R
Chemical Name:
7H-Phenaleno[1,2-c]thiophen-7-one
CAS Number:
30415-24-8
Molecular Formula:
C15H8OS
Molecular Weight:
236.2884
IUPAC Name:
phenaleno[1,2-c]thiophen-7-one
InChI:
InChI=1S/C15H8OS/c16-15-11-6-2-4-9-3-1-5-10(14(9)11)12-7-17-8-13(12)15/h1-8H
InChI Key:
HXVCFLUNUDEEBI-UHFFFAOYSA-N
SMILES:
O=C1c2cscc2c2c3c1cccc3ccc2
NSC Number:
149691
Properties
Complexity:
340
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
236.03g/mol
Formal Charge:
0
Heavy Atom Count:
17
Hydrogen Bond Acceptor Count:
2
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
236.288g/mol
Monoisotopic Mass:
236.03g/mol
Rotatable Bond Count:
0
Topological Polar Surface Area:
45.3A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
4
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