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153823-24-6 | Acetaldehyde, bis(phenylthio)-
CAS No: 153823-24-6 Catalog No: AG007HIC MDL No:
Product Description
Catalog Number:
AG007HIC
Chemical Name:
Acetaldehyde, bis(phenylthio)-
CAS Number:
153823-24-6
Molecular Formula:
C14H12OS2
Molecular Weight:
260.3745
IUPAC Name:
2,2-bis(phenylsulfanyl)acetaldehyde
InChI:
InChI=1S/C14H12OS2/c15-11-14(16-12-7-3-1-4-8-12)17-13-9-5-2-6-10-13/h1-11,14H
InChI Key:
OQBOHZKPJOOCSE-UHFFFAOYSA-N
SMILES:
O=CC(Sc1ccccc1)Sc1ccccc1
Properties
Complexity:
200
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
260.033g/mol
Formal Charge:
0
Heavy Atom Count:
17
Hydrogen Bond Acceptor Count:
3
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
260.369g/mol
Monoisotopic Mass:
260.033g/mol
Rotatable Bond Count:
5
Topological Polar Surface Area:
67.7A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
4.3
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