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113496-17-6 | Naphthalene, 2-(ethylsulfinyl)-
CAS No: 113496-17-6 Catalog No: AG0008RC MDL No:
Product Description
Catalog Number:
AG0008RC
Chemical Name:
Naphthalene, 2-(ethylsulfinyl)-
CAS Number:
113496-17-6
Molecular Formula:
C12H12OS
Molecular Weight:
204.2881
IUPAC Name:
2-ethylsulfinylnaphthalene
InChI:
InChI=1S/C12H12OS/c1-2-14(13)12-8-7-10-5-3-4-6-11(10)9-12/h3-9H,2H2,1H3
InChI Key:
VEFQTQCAYJJXIT-UHFFFAOYSA-N
SMILES:
CCS(=O)c1ccc2c(c1)cccc2
Properties
Complexity:
214
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
204.061g/mol
Formal Charge:
0
Heavy Atom Count:
14
Hydrogen Bond Acceptor Count:
2
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
204.287g/mol
Monoisotopic Mass:
204.061g/mol
Rotatable Bond Count:
2
Topological Polar Surface Area:
36.3A^2
Undefined Atom Stereocenter Count:
1
Undefined Bond Stereocenter Count:
0
XLogP3:
2.6
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