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Home > Aldehydes > 918341-22-7
918341-22-7 | Benzaldehyde, 4-[(1E)-2-(phenylsulfonyl)ethenyl]-
CAS No: 918341-22-7 Catalog No: AG006SHE MDL No:
Product Description
Catalog Number:
AG006SHE
Chemical Name:
Benzaldehyde, 4-[(1E)-2-(phenylsulfonyl)ethenyl]-
CAS Number:
918341-22-7
Molecular Formula:
C15H12O3S
Molecular Weight:
272.3190
IUPAC Name:
4-[2-(benzenesulfonyl)ethenyl]benzaldehyde
InChI:
InChI=1S/C15H12O3S/c16-12-14-8-6-13(7-9-14)10-11-19(17,18)15-4-2-1-3-5-15/h1-12H
InChI Key:
JDVOLYIOZCVDSF-UHFFFAOYSA-N
SMILES:
O=Cc1ccc(cc1)/C=C/S(=O)(=O)c1ccccc1
Properties
Complexity:
405
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
272.051g/mol
Formal Charge:
0
Heavy Atom Count:
19
Hydrogen Bond Acceptor Count:
3
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
272.318g/mol
Monoisotopic Mass:
272.051g/mol
Rotatable Bond Count:
4
Topological Polar Surface Area:
59.6A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
1
XLogP3:
2.6
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