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PHENYL ISOCYANATE | ||
PRODUCT IDENTIFICATION |
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CAS NO. | 103-71-9 |
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EINECS NO. | 203-137-6 | |
FORMULA | C6H5NCO | |
MOL WT. | 119.12 | |
H.S. CODE |
929.10.8090 | |
TOXICITY | Oral rat LD50: 800 mg/kg | |
SYNONYMS | Isocyanic acid phenyl ester; | |
Carbanil; Isocyanatobenzene; Phenylcarbimide; Phenylic mustard oil; Phenylisocyanat (German); Isocianato de fenilo (Spanish); Isocyanate de phényle (French); Fenylisokyanat; Karbanil (Czech); Phenyl carbonimide; Phenyl isocyanate; | ||
SMILES | c1ccc(cc1)N=C=O | |
CLASSIFICATION |
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EXTRA NOTES |
UN2487 [Poison] |
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PHYSICAL AND CHEMICAL PROPERTIES | ||
PHYSICAL STATE | clear iquid | |
MELTING POINT | -33 - -31 C | |
BOILING POINT | 160 C | |
SPECIFIC GRAVITY | 1.09 - 1.11 | |
SOLUBILITY IN WATER | Hydrolyses | |
SOLVENT SOLUBILITY |
Decomposes in alcohol Soluble in ether |
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log P | 2.59 (Octanol-water) | |
pH | ||
VAPOR DENSITY | ||
AUTOIGNITION |
645 C | |
NFPA RATINGS |
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REFRACTIVE INDEX |
1.534 | |
FLASH POINT | 51 C | |
STABILITY | Stable under ordinary conditions. Moisture sensitive | |
EXTERNAL LINKS & GENERAL DESCRIPTION |
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Drug Information Portal (U.S. National Library of Medicine) - Phenylisocyanate PubChem Compound Summary - Phenylisocyanate ACUTE EXPOSURE GUIDELINE LEVELS (AEGLs) - Phenylisocyanate Drug Bank - Phenylisocyanate KEGG (Kyoto Encyclopedia of Genes and Genomes) - Phenylisocyanate http://www.ebi.ac.uk/ - Phenylisocyanate http://www.ncbi.nlm.nih.gov/ - Phenylisocyanate Local:
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. |
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SALES SPECIFICATION | ||
APPEARANCE |
clear liquid | |
ASSAY | 98.0% min | |
SPECIFIC GRAVITY | 1.09 - 1.11 | |
TRANSPORTATION | ||
PACKING | ||
HAZARD CLASS | 6.1 (Packing Group: I) | |
UN NO. | 2487 | |
SAFETY INFORMATION | ||
HAZARD OVERVIEW |
Flammable liquid and vapor. Causes skin irritation. May cause allergic respiratory reaction. Water-reactive. Lachrymator (substance which increases the flow of tears). May be harmful if swallowed. Causes severe eye irritation. Causes digestive and respiratory tract irritation. May be fatal if inhaled. Target Organs: Lungs. |
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GHS |
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SIGNAL WORD |
Danger |
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PICTOGRAMS |
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HAZARD STATEMENTS |
H226-H302-H314-H317-H330-H334 |
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P STATEMENTS |
P260-P280-P284-P305 + P351 + P338-P310 |
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EC DIRECTIVES |
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HAZARD CODES |
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RISK PHRASES |
10-22-26-34-42-52 |
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SAFETY PHRASES |
16-26-28-36/37/39-45 |
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PRICE INFORMATION | ||
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