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10276-14-9 | Benzene, [(3-phenyl-2-propen-1-yl)thio]-
CAS No: 10276-14-9 Catalog No: AG0008B9 MDL No:
Product Description
Catalog Number:
AG0008B9
Chemical Name:
Benzene, [(3-phenyl-2-propen-1-yl)thio]-
CAS Number:
10276-14-9
Molecular Formula:
C15H14S
Molecular Weight:
226.3367
IUPAC Name:
3-phenylprop-2-enylsulfanylbenzene
InChI:
InChI=1S/C15H14S/c1-3-8-14(9-4-1)10-7-13-16-15-11-5-2-6-12-15/h1-12H,13H2
InChI Key:
FEHPZIJSLMHZSJ-UHFFFAOYSA-N
SMILES:
c1ccc(cc1)SCC=Cc1ccccc1
Properties
Complexity:
198
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
226.082g/mol
Formal Charge:
0
Heavy Atom Count:
16
Hydrogen Bond Acceptor Count:
1
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
226.337g/mol
Monoisotopic Mass:
226.082g/mol
Rotatable Bond Count:
4
Topological Polar Surface Area:
25.3A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
1
XLogP3:
4.6
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