2-(1,3-dithiol-2-ylidene)-5,6-dihydro-[1,3]dithiolo[4,5-b][1,4]dithiin structure

3D Mol Similar

2-(1,3-dithiol-2-ylidene)-5,6-dihydro-[1,3]dithiolo[4,5-b][1,4]dithiin

: Iupac Name：2-(1,3-dithiol-2-ylidene)-5,6-dihydro-[1,3]dithiolo[4,5-b][1,4]dithiine; CAS No.: 97307-49-8; Molecular Weight：294.5; Modify Date.: 2022-11-05 09:31

Request For Quotation

1. Names and Identifiers

: 1.1 Name; 2-(1,3-dithiol-2-ylidene)-5,6-dihydro-[1,3]dithiolo[4,5-b][1,4]dithiin

2. Properties

2.1 Precise Quality: 293.87900

2.1 PSA: 151.80000

2.1 logP: 5.15080

3. Synthesis Route

97307-49-8Total: 9 Synthesis Route

59089-89-3 14 Suppliers

97307-49-8

Literatures:
McCullough, Richard D.; Petruska, Melissa A.; Belot, John A. Tetrahedron, 1999 , vol. 55, # 33 p. 9979 - 9998
Yield: null

74962-29-1 12 Suppliers

97307-49-8

Literatures:
Papavassiliou, G.C.; Zambounis, J.S.; Mousdis, G.A.; Gionis, V.; Yiannopoulos, S.Y. Molecular Crystals and Liquid Crystals (1969-1991), 1988 , vol. 156, p. 269 - 276
Yield: null

118148-21-3

97307-49-8

Literatures:
McCullough, Richard D.; Petruska, Melissa A.; Belot, John A. Tetrahedron, 1999 , vol. 55, # 33 p. 9979 - 9998
Yield: ~65%

View all

4. Computational chemical data

Molecular Weight: 294.5g/mol
Molecular Formula: C₈H₆S₆
Compound Is Canonicalized: True
XLogP3-AA: 3.7
Exact Mass: 293.87937723
Monoisotopic Mass: 293.87937723
Complexity: 323
Rotatable Bond Count: 0
Hydrogen Bond Donor Count: 0
Hydrogen Bond Acceptor Count: 6
Topological Polar Surface Area: 152
Heavy Atom Count: 14
Defined Atom Stereocenter Count: 0
Undefined Atom Stereocenter Count: 0
Defined Bond Stereocenter Count: 0
Undefined Bond Stereocenter Count: 0
Isotope Atom Count: 0
Covalently-Bonded Unit Count: 1
CACTVS Substructure Key Fingerprint: AAADcYBwAABwAAAAAAAAAAAAAAAAAQIAAAAgAAAAAAAAAEgAAAAAGAQAAAAAAACEQACAAAAAAAiAAAACAAAAAQAAABAIAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAA==

6. Realated Product Infomation

101751-48-8 1,3-Dithiolo[4,5-b][1,4]dithiin-5,6-d2,2-(5,6-dihydro-5,6-d2-1,3-dithiolo[4,5-b][1,4]dithiin-2-ylidene-5,6-d2)-5,6-dihydro-5,6-d2-(9CI)

202126-48-5 5-PROPYL-1,3-DITHIOLO[4,5-D][1,3]DITHIOLE-2-THIONE

202126-51-0 5-HEXYL-1,3-DITHIOLO[4,5-D][1,3]DITHIOLE-2-THIONE

218149-71-4 1,3-Dithiole-4-methanethiol, 2-(1,3-dithiol-2-ylidene)-

23230-01-5 2,3-dihydro-[1,4]dithiine

87258-18-2 1,3-Dithiole-4,5-dicarboxaldehyde, 2-(4,5-diformyl-1,3-dithiol-2-ylidene)-

24519-85-5 5,6-DIHYDRO-1,4-DITHIIN-2,3-DICARBOXIMIDE

Recently Updated : 1566722-26-6 1565025-23-1 1564889-53-7 1566621-11-1 1566247-71-9 1566157-97-8 1566246-39-6 1564860-12-3 1565492-22-9 1566156-49-7