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PHENYLACETONITRILE | ||
PRODUCT IDENTIFICATION |
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CAS NO. | 140-29-4 |
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EINECS NO. | 205-410-5 | |
FORMULA | C6H5CH2CN | |
MOL WT. | 117.15 | |
H.S. CODE | 2926.90.4800 | |
TOXICITY | Oral rat LD50: 270 mg/kg | |
SYNONYMS | Benzeneacetonitrile; Benzyl cyanide; (Cyanomethyl)benzene; | |
Cyanomethylbenzene; Benzyl nitrile; ¥ø-Cyanotoluene; (Cyanomethyl)benzene; Phenyl acetyl nitrile; Phenacetonitrile; Benzenediacetonitrile; alpha-Tolunitrile; Benzeneacetonitrile; 2-Phenylacetonitrile; BnCN; | ||
SMILES | c1(ccccc1)CC#N | |
CLASSIFICATION |
Nitrile | |
EXTRA NOTES |
UN2470 [Poison] Drug Enforcement Administration (DEA) List I |
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PHYSICAL AND CHEMICAL PROPERTIES |
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PHYSICAL STATE | Clear to pale yellow liquid | |
MELTING POINT | -24 C | |
BOILING POINT | 234 C | |
SPECIFIC GRAVITY | 1.02 | |
SOLUBILITY IN WATER |
117.2 g/l 20 C | |
pH |
11.0 - 12.0 at 117.2 g/l at 25 C | |
VAPOR DENSITY | 4.1 | |
log P |
1.56 (octanol-water) | |
NFPA RATINGS |
Health: 4 Flammability: 1 Reactivity: 0 | |
REFRACTIVE INDEX |
1.523 | |
FLASH POINT | 101 C | |
STABILITY | Stable under ordinary conditions | |
EXTERNAL LINKS & GENERAL DESCRIPTION |
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Drug Information Portal (U.S. National Library of Medicine) - Benzyl cyanide PubChem Compound Summary - Benzyl cyanide KEGG (Kyoto Encyclopedia of Genes and Genomes) - Benzyl cyanide http://www.ebi.ac.uk/ - Benzyl cyanide http://www.ncbi.nlm.nih.gov/ - Benzyl cyanide http://forendex.southernforensic.org/ Southern Association of Forensic Scientists - Benzyl cyanideLocal: ·
Extraction solvent for fatty acids,
oils and unsaturated hydrocarbons Benzyl cyanide is used in organic synthesis for dyes, perfumes, pesticides, pharmaceuticals, especially penicillin precursors. |
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SALES SPECIFICATION | ||
APPEARANCE |
Clear to pale yellow liquid | |
PURITY |
98.5% min | |
DENSITY |
1.014-1.017 | |
BENZYL CHORIDE |
0.5% max | |
BENZYL ALCOHOL |
0.8% max | |
WATER |
0.5% max | |
TRANSPORTATION | ||
PACKING | ||
HAZARD CLASS | 6.1 (Packing group: III) | |
UN NO. | 2470 | |
SAFETY INFORMATION | ||
HAZARD OVERVIEW |
Target Organ Effect, Highly toxic by inhalation, Toxic by ingestion, Toxic by skin absorption. Target Organs: Central nervous system, Blood, Lungs, Cardiovascular system., Thyroid. |
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GHS |
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SIGNAL WORD | Danger | |
PICTOGRAMS |
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HAZARD STATEMENTS |
H301-H311-H330 |
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P STATEMENTS |
P260-P280-P284-P310 |
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EC DIRECTIVES |
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HAZARD CODES |
T+ |
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RISK PHRASES |
22-24-26 |
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SAFETY PHRASES |
28-36/37-45 |
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PRICE INFORMATION | ||
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