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96014-41-4 | Acetaldehyde, tris(phenylthio)-
CAS No: 96014-41-4 Catalog No: AG006TJI MDL No:
Product Description
Catalog Number:
AG006TJI
Chemical Name:
Acetaldehyde, tris(phenylthio)-
CAS Number:
96014-41-4
Molecular Formula:
C20H16OS3
Molecular Weight:
368.5354
IUPAC Name:
2,2,2-tris(phenylsulfanyl)acetaldehyde
InChI:
InChI=1S/C20H16OS3/c21-16-20(22-17-10-4-1-5-11-17,23-18-12-6-2-7-13-18)24-19-14-8-3-9-15-19/h1-16H
InChI Key:
KRONGMFVRYBCEI-UHFFFAOYSA-N
SMILES:
O=CC(Sc1ccccc1)(Sc1ccccc1)Sc1ccccc1
Properties
Complexity:
319
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
368.036g/mol
Formal Charge:
0
Heavy Atom Count:
24
Hydrogen Bond Acceptor Count:
4
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
368.527g/mol
Monoisotopic Mass:
368.036g/mol
Rotatable Bond Count:
7
Topological Polar Surface Area:
93A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
6.4
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