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197565-73-4 | Benzofuran, 2-(hexadecylthio)-
CAS No: 197565-73-4 Catalog No: AG002AVJ MDL No:
Product Description
Catalog Number:
AG002AVJ
Chemical Name:
Benzofuran, 2-(hexadecylthio)-
CAS Number:
197565-73-4
Molecular Formula:
C24H38OS
Molecular Weight:
374.6229
IUPAC Name:
2-hexadecylsulfanyl-1-benzofuran
InChI:
InChI=1S/C24H38OS/c1-2-3-4-5-6-7-8-9-10-11-12-13-14-17-20-26-24-21-22-18-15-16-19-23(22)25-24/h15-16,18-19,21H,2-14,17,20H2,1H3
InChI Key:
PPURAMMSPWCLLA-UHFFFAOYSA-N
SMILES:
CCCCCCCCCCCCCCCCSc1cc2c(o1)cccc2
Properties
Complexity:
319
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
374.264g/mol
Formal Charge:
0
Heavy Atom Count:
26
Hydrogen Bond Acceptor Count:
2
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
374.627g/mol
Monoisotopic Mass:
374.264g/mol
Rotatable Bond Count:
16
Topological Polar Surface Area:
38.4A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
10.9
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