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128881-70-9 | 1,3-Dithiole, 2-(1,3-dithiol-2-ylidene)-4-(octadecylseleno)-
CAS No: 128881-70-9 Catalog No: AG000YGQ MDL No:
Product Description
Catalog Number:
AG000YGQ
Chemical Name:
1,3-Dithiole, 2-(1,3-dithiol-2-ylidene)-4-(octadecylseleno)-
CAS Number:
128881-70-9
Molecular Formula:
C24H40S4Se
Molecular Weight:
535.7944
IUPAC Name:
2-(1,3-dithiol-2-ylidene)-4-octadecylselanyl-1,3-dithiole
InChI:
InChI=1S/C24H40S4Se/c1-2-3-4-5-6-7-8-9-10-11-12-13-14-15-16-17-20-29-22-21-27-24(28-22)23-25-18-19-26-23/h18-19,21H,2-17,20H2,1H3
InChI Key:
GMDVFUVUZHBMDV-UHFFFAOYSA-N
SMILES:
CCCCCCCCCCCCCCCCCC[Se]C1=CSC(=C2SC=CS2)S1
Properties
Complexity:
503
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
536.118g/mol
Formal Charge:
0
Heavy Atom Count:
29
Hydrogen Bond Acceptor Count:
4
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
535.795g/mol
Monoisotopic Mass:
536.118g/mol
Rotatable Bond Count:
18
Topological Polar Surface Area:
101A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
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