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82131-18-8 | Anthracene, 9-(ethylthio)-
CAS No: 82131-18-8 Catalog No: AG004W69 MDL No:
Product Description
Catalog Number:
AG004W69
Chemical Name:
Anthracene, 9-(ethylthio)-
CAS Number:
82131-18-8
Molecular Formula:
C16H14S
Molecular Weight:
238.3474
IUPAC Name:
9-ethylsulfanylanthracene
InChI:
InChI=1S/C16H14S/c1-2-17-16-14-9-5-3-7-12(14)11-13-8-4-6-10-15(13)16/h3-11H,2H2,1H3
InChI Key:
BFXRBQAVIWZDLF-UHFFFAOYSA-N
SMILES:
CCSc1c2ccccc2cc2c1cccc2
Properties
Complexity:
228
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
238.082g/mol
Formal Charge:
0
Heavy Atom Count:
17
Hydrogen Bond Acceptor Count:
1
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
238.348g/mol
Monoisotopic Mass:
238.082g/mol
Rotatable Bond Count:
2
Topological Polar Surface Area:
25.3A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
5.4
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