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147819-28-1 | 1,5,3,2,4-Dioxathiadiphosphepane, 2,4-bis(4-methoxyphenyl)-, 2,4-disulfide
CAS No: 147819-28-1 Catalog No: AG001F8M MDL No:
Product Description
Catalog Number:
AG001F8M
Chemical Name:
1,5,3,2,4-Dioxathiadiphosphepane, 2,4-bis(4-methoxyphenyl)-, 2,4-disulfide
CAS Number:
147819-28-1
Molecular Formula:
C16H18O4P2S3
Molecular Weight:
432.4542
IUPAC Name:
2,4-bis(4-methoxyphenyl)-2,4-bis(sulfanylidene)-1,5,3,2λ5,4λ5-dioxathiadiphosphepane
InChI:
InChI=1S/C16H18O4P2S3/c1-17-13-3-7-15(8-4-13)21(23)19-11-12-20-22(24,25-21)16-9-5-14(18-2)6-10-16/h3-10H,11-12H2,1-2H3
InChI Key:
JPGYAYPPBVKALA-UHFFFAOYSA-N
SMILES:
COc1ccc(cc1)P1(=S)OCCOP(=S)(S1)c1ccc(cc1)OC
NSC Number:
678865
Properties
Complexity:
486
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
431.984g/mol
Formal Charge:
0
Heavy Atom Count:
25
Hydrogen Bond Acceptor Count:
7
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
432.444g/mol
Monoisotopic Mass:
431.984g/mol
Rotatable Bond Count:
4
Topological Polar Surface Area:
126A^2
Undefined Atom Stereocenter Count:
2
Undefined Bond Stereocenter Count:
0
XLogP3:
5.5
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