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88531-09-3 | Benzene, [2-[[2-[(2-phenylethenyl)oxy]ethyl]thio]ethenyl]-
CAS No: 88531-09-3 Catalog No: AG00458H MDL No:
Product Description
Catalog Number:
AG00458H
Chemical Name:
Benzene, [2-[[2-[(2-phenylethenyl)oxy]ethyl]thio]ethenyl]-
CAS Number:
88531-09-3
Molecular Formula:
C18H18OS
Molecular Weight:
282.3999
IUPAC Name:
2-[2-(2-phenylethenoxy)ethylsulfanyl]ethenylbenzene
InChI:
InChI=1S/C18H18OS/c1-3-7-17(8-4-1)11-13-19-14-16-20-15-12-18-9-5-2-6-10-18/h1-13,15H,14,16H2
InChI Key:
VZXJANYZZUIZCB-UHFFFAOYSA-N
SMILES:
C(OC=Cc1ccccc1)CSC=Cc1ccccc1
Properties
Complexity:
286
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
282.108g/mol
Formal Charge:
0
Heavy Atom Count:
20
Hydrogen Bond Acceptor Count:
2
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
282.401g/mol
Monoisotopic Mass:
282.108g/mol
Rotatable Bond Count:
7
Topological Polar Surface Area:
34.5A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
2
XLogP3:
5
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