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68400-79-3 | bis(2,6,6-trimethylbicyclo[3.1.1]hept-2-enyl) bis(2,6,6-trimethylbicyclo[3.1.1]hept-2-enyl)thiodiphosphonate
CAS No: 68400-79-3 Catalog No: AG00FL5L MDL No:
Product Description
Catalog Number:
AG00FL5L
Chemical Name:
bis(2,6,6-trimethylbicyclo[3.1.1]hept-2-enyl) bis(2,6,6-trimethylbicyclo[3.1.1]hept-2-enyl)thiodiphosphonate
CAS Number:
68400-79-3
IUPAC Name:
sulfanylidene-(2,6,6-trimethyl-3-bicyclo[3.1.1]hept-2-enyl)-[(2,6,6-trimethyl-3-bicyclo[3.1.1]hept-2-enyl)sulfanyl]-[(2,6,6-trimethyl-3-bicyclo[3.1.1]hept-2-enyl)-[(2,6,6-trimethyl-3-bicyclo[3.1.1]hept-2-enyl)sulfanyl]phosphinothioyl]sulfanyl-λ5-phosphane
InChI:
InChI=1S/C40H60P2S5/c1-21-29-13-25(37(29,5)6)17-33(21)41(43,45-35-19-27-15-31(23(35)3)39(27,9)10)47-42(44,34-18-26-14-30(22(34)2)38(26,7)8)46-36-20-28-16-32(24(36)4)40(28,11)12/h25-32H,13-20H2,1-12H3
InChI Key:
ZZMOHCWFHCHISQ-UHFFFAOYSA-N
EC Number:
270-050-8
Properties
Complexity:
1560
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
762.277g/mol
Formal Charge:
0
Heavy Atom Count:
47
Hydrogen Bond Acceptor Count:
5
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
763.168g/mol
Monoisotopic Mass:
762.277g/mol
Rotatable Bond Count:
8
Topological Polar Surface Area:
140A^2
Undefined Atom Stereocenter Count:
10
Undefined Bond Stereocenter Count:
0
XLogP3:
12.3
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