Cas no 21879-17-4 ([4-(1,3-Dithiol-2-ylidene)cyclohexa-2,5-dien-1-ylidene]propanedinitrile)

[4-(1,3-Dithiol-2-ylidene)cyclohexa-2,5-dien-1-ylidene]propanedinitrile structure
21879-17-4 structure
Product Name:[4-(1,3-Dithiol-2-ylidene)cyclohexa-2,5-dien-1-ylidene]propanedinitrile
CAS No:21879-17-4
MF:C12H6N2S2
MW:242.319439411163
CID:2836105
PubChem ID:57578272
Update Time:2025-04-21

[4-(1,3-Dithiol-2-ylidene)cyclohexa-2,5-dien-1-ylidene]propanedinitrile Chemical and Physical Properties

Names and Identifiers

    • propanedinitrile, 2-[4-(1,3-dithiol-2-ylidene)-2,5-cyclohexadien-1-ylidene]-
    • SCHEMBL12172669
    • BIFYJJAFYPUCPB-UHFFFAOYSA-N
    • [4-(1,3-dithiol-2-ylidene)cyclohexa-2,5-dien-1-ylidene]propanedinitrile
    • 21879-17-4
    • [4-(2H-1,3-Dithiol-2-ylidene)cyclohexa-2,5-dien-1-ylidene]propanedinitrile
    • DTXSID60727185
    • [4-(1,3-Dithiol-2-ylidene)cyclohexa-2,5-dien-1-ylidene]propanedinitrile
    • Inchi： 1S/C12H6N2S2/c13-7-11(8-14)9-1-3-10(4-2-9)12-15-5-6-16-12/h1-6H
    • InChI Key： BIFYJJAFYPUCPB-UHFFFAOYSA-N
    • SMILES： S1C=CSC1=C1C=CC(=C(C#N)C#N)C=C1 |c:5,9|

Computed Properties

  • Exact Mass: 241.99724055Da
  • Monoisotopic Mass: 241.99724055Da
  • Isotope Atom Count: 0
  • Hydrogen Bond Donor Count: 0
  • Hydrogen Bond Acceptor Count: 4
  • Heavy Atom Count: 16
  • Rotatable Bond Count: 0
  • Complexity: 525
  • Covalently-Bonded Unit Count: 1
  • Defined Atom Stereocenter Count: 0
  • Undefined Atom Stereocenter Count : 0
  • Defined Bond Stereocenter Count: 0
  • Undefined Bond Stereocenter Count: 0
  • XLogP3: 2.3
  • Topological Polar Surface Area: 98.2?2

[4-(1,3-Dithiol-2-ylidene)cyclohexa-2,5-dien-1-ylidene]propanedinitrile Related Literature

21879-17-4 ([4-(1,3-Dithiol-2-ylidene)cyclohexa-2,5-dien-1-ylidene]propanedinitrile) Related Products

Recommended suppliers
HANGZHOU BAIS CHEMICAL TECHNOLOGY CO., LTD.
Gold Member
Audited Supplier Audited Supplier
CN Supplier
Reagent
HANGZHOU BAIS CHEMICAL TECHNOLOGY CO., LTD.
Shaanxi pure crystal photoelectric technology co. LTD
Gold Member
Audited Supplier Audited Supplier
CN Supplier
Reagent
Shaanxi pure crystal photoelectric technology co. LTD
ASIACHEM I&E (JIANGSU) CO., LTD
Gold Member
Audited Supplier Audited Supplier
CN Supplier
Bulk
ASIACHEM I&E (JIANGSU) CO., LTD
上海帛亦醫(yī)藥科技有限公司
Gold Member
Audited Supplier Audited Supplier
CN Supplier
Reagent
Amadis Chemical Company Limited
Gold Member
Audited Supplier Audited Supplier
CN Supplier
Reagent
Amadis Chemical Company Limited