cis,cis-Mucononitrile

Base Information

• Chemical Name: cis,cis-Mucononitrile
• CAS No.: 1557-59-1
• Molecular Formula: C6H4 N2
• Molecular Weight: 104.111
• European Community (EC) Number: 623-255-5
• UNII: U6GQ3TN24V
• Mol file: 1557-59-1.mol

Synonyms:cis,cis-Mucononitrile;1557-59-1;(2Z,4Z)-hexa-2,4-dienedinitrile;2,4-Hexadienedinitrile, (2Z,4Z)-;(2Z,4Z)-2,4-Hexadienedinitrile;2,4-Hexadienedinitrile, (Z,Z)-;U6GQ3TN24V;cis,cis-1,4-Dicyano-1,3-butadiene;821-60-3;UNII-U6GQ3TN24V;cis,cis-Mucononitrile, 98%;(Z,Z)-2,4-Hexadienedinitrile;QLQYLCRMTTXKHS-CCAGOZQPSA-N;(2Z,4Z)-2,4-Hexadienedinitrile #;A840261;J-009223

Chemical Property of cis,cis-Mucononitrile

Chemical Property:

• Vapor Pressure: 0.03mmHg at 25°C
• Melting Point: 128-131 °C(lit.)
• Refractive Index: 1.498
• Boiling Point: 244.7°C at 760 mmHg
• Flash Point: 115.6°C
• PSA: 47.58000
• Density: 1.024g/cm³
• LogP: 1.14596
• XLogP3: 0.6
• Hydrogen Bond Donor Count: 0
• Hydrogen Bond Acceptor Count: 2
• Rotatable Bond Count: 1
• Exact Mass: 104.037448136
• Heavy Atom Count: 8
• Complexity: 169

Purity/Quality:

98%,99%, ^*data from raw suppliers

cis,cis-Mucononitrile 98% ^*data from reagent suppliers

Safty Information:

• Hazard Codes: Xn
• Statements: 20/21/22-36/37/38
• Safety Statements: 26-37/39

MSDS Files:

SDS file from LookChem

Useful:

• Canonical SMILES: C(=CC#N)C=CC#N
• Isomeric SMILES: C(=C\C#N)\C=C/C#N
• Uses: cis,cis-Mucononitrile may be used in chemical synthesis.

Technology Process of cis,cis-Mucononitrile

There total 5 articles about cis,cis-Mucononitrile which guide to synthetic route it. The literature collected by LookChem mainly comes from the sharing of users and the free literature resources found by Internet computing technology. We keep the original model of the professional version of literature to make it easier and faster for users to retrieve and use. At the same time, we analyze and calculate the most feasible synthesis route with the highest yield for your reference as below:

synthetic route:

Reference yield:

cyclohexane (110-82-7,25012-93-5) → butanedinitrile (110-61-2) + maleonitrile (928-53-0,764-42-1,17656-09-6,62600-65-1,62742-11-4) + cis,cis-mucononitrile (1557-59-1) + Glutaronitrile (544-13-8) + hexanedinitrile (111-69-3) + benzene (71-43-2,26181-88-4,54682-86-9,13967-78-7,174973-66-1)

Guidance literature:

With ammonia; TiO₂ (Ti-Mo-oxides); molybdenum(VI) oxide; at 460 ℃; under 735.5 Torr; Product distribution; various catalysts;

Reference yield:

benzene (71-43-2,26181-88-4,54682-86-9,13967-78-7,174973-66-1) → maleonitrile (928-53-0,764-42-1,17656-09-6,62600-65-1,62742-11-4) + cis,cis-mucononitrile (1557-59-1) + 1,2-Dicyanoethylene (764-42-1)

Guidance literature:

With ammonia; solide solution (V-Mo-oxides); at 465 ℃; under 735.5 Torr;

Reference yield:

benzene (71-43-2,26181-88-4,54682-86-9,13967-78-7,174973-66-1) → maleonitrile (928-53-0,764-42-1,17656-09-6,62600-65-1,62742-11-4) + cis,cis-mucononitrile (1557-59-1) + cis,trans-mucononitrile (29750-70-7) + 1,2-Dicyanoethylene (764-42-1)

Guidance literature:

With ammonia; solide solution (V-Mo-oxides); at 470 ℃; under 735.5 Torr;

upstream raw materials:

benzene

cyclohexane

1,2-diamino-benzene

dimethyl acetylenedicarboxylate

Downstream raw materials:

1,6-Hexanediamine

Refernces

• 1、 Simon, Gerard,Germain, Jean-Eugene. "AMMOXYDATION CATALYTIQUE DES HYDROCARBURES ET REACTIONS APPARENTEES. XXII. AMMOXYDATION DU BENZENE ET DU CYCLOHEXANE". . p. 149 - 155. Retrieved 2007/10/02.