CYCLOHEXYL ISOCYANATE

PRODUCT IDENTIFICATION
CAS NO. 3173-53-3

CYCLOHEXYL ISOCYANATE
EINECS NO. 221-639-3
FORMULA C7H11NO
MOL WT. 125.17

H.S. CODE

 2929.10
TOXICITY  
SYNONYMS Isocyanic acid cyclohexylester; Isocyanatocyclohexane;
Cyclohexylisocyanat (Dutch); Isocianato de ciclohexilo (Spanish); Isocyanate de cyclohexyle (French);
SMILES  

CLASSIFICATION

 

PHYSICAL AND CHEMICAL PROPERTIES
PHYSICAL STATE clear to lightly yellow liquid
MELTING POINT -80 C
BOILING POINT 168 - 170 C
SPECIFIC GRAVITY 0.98
SOLUBILITY IN WATER Hydrolyses
pH  
VAPOR DENSITY  

AUTOIGNITION

  

NFPA RATINGS

 Health: 2; Flammability: 2; Reactivity: 2

REFRACTIVE INDEX

 1.455
FLASH POINT 48 C
STABILITY Stable under ordinary conditions. Moisture sensitive

GENERAL DESCRIPTION AND APPLICATIONS
Cyanic acid (the isomer of fulminic acid) is an unstable (explosive), poisonous, volatile, clear liquid with the structure of H-O-C≡N (the oxoacid formed from the pseudohalogen cyanide), which is readily converted to cyamelide and fulminic acid. There is another isomeric cyanic acid with the structure of H-N=C=O, called isocyanic acid. Cyanate group (and isocyanate group) can react with itself. Cyanuric acid (also called pyrolithic acid), white monoclinic crystal with the structure of [HOC(NCOH)2N], is the trimer of cyanic acid. The trimer of isocyanic acid is called biuret.
  • Cyanic acid: H-N=C=O or H-O-C≡N
  • Fulminic acid: (H-C=N-O) or H-C≡N-O
  • Isocyanic acid: H-N=C=O
  • Cyanuric acid: HOC(NCOH)2N
  • Biuret: (NH2)CO)2 NH

Cyanic acid hydrolyses to ammonia and carbon dioxide in water. The salts and esters of cyanic acid are cyanates. But esters of normal cyanic acid are not known. The salts and esters of isocyanic acid are isocyanates. The isocyanate group reacts with the hydroxyl functional group to form a urethane linkage. Diisocyanates (or polyisocyanates) are monomers for polyurethane production. Polyurethane is made from a variety of diisocyanates in conjunction with polyether and polyester polyols as co-reactants by addition polymerization which needs at least two -N=C=O groups. Polyurethanes are widely used in the manufacture of flexible and rigid foams, fibres, coatings, and elastomers. If isocyanate monomer is polymerized with amine group, polyurea is produced. Cyanates (or Isocyanates) are readily reacts with various form of amine (including ammonia, primary-, secondary-amines, amides and ureas) and hydroxyl functional group. They are used in the synthesis for the target molecules such as pharmaceuticals, pesticides, textile softener, lubricants and industrial disinfectants. They can convert to polycyclic compounds such as hydantoins and imidazolons. They are used as plastic additives and as heat treatment salt formulations for metals. Cyclohexyl Isocyanate is used in chemical manufacturing including agrochemicals, Pharmaceutical agents and Polymer auxiliaries.
SALES SPECIFICATION

APPEARANCE

clear to lightly yellow liquid
ASSAY 98.0% min
BOILING POINT 167 - 170 C
TRANSPORTATION
PACKING 200kgs in drum
HAZARD CLASS 6.1 (Packing Group: II)
UN NO. 2488
OTHER INFORMATION
Hazard Symbols: T+, Risk Phrases: 10-26-36/37/38-42, Safety Phrases: 26-28-36/37-45