AM0210000 [RTECS]

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Names

[ CAS No. ]:
459-22-3

[ Name ]:
AM0210000 [RTECS]

[Synonym ]:
4-Fluorobenzeneacetonitrile
Benzeneacetonitrile, 4-fluoro-
4-Fluorobenzyl
4-Fluorophenylacetonitrile
Acetonitrile, (p-fluorophenyl)-
PARA-FLUOROBENZYL CYANIDE
p-Fluorobenzyl cyanide
2-(4-Fluorophenyl)acetonitrile
(p-Fluorophenyl)acetonitrile
4-FLUOROBENZYLNITRILE
MFCD00001917
p-Fluorobenzyl nitrile
4-Fluorobenzyl cyanide
4-Fluoroacetonitrile
(4-Fluorophenyl)acetonitrile
AM0210000 [RTECS]
EINECS 207-286-8
4-fluorobenzylacetonitrile
p-Fluorophenylacetonitrile
NC1R DF

Chemical & Physical Properties

[ Density]:
1.1±0.1 g/cm3

[ Boiling Point ]:
234.2±0.0 °C at 760 mmHg

[ Melting Point ]:
86ºC

[ Molecular Formula ]:
C8H6FN

[ Molecular Weight ]:
135.138

[ Flash Point ]:
108.3±0.0 °C

[ Exact Mass ]:
135.048431

[ PSA ]:
23.79000

[ LogP ]:
1.50

[ Vapour Pressure ]:
0.1±0.4 mmHg at 25°C

[ Index of Refraction ]:
1.508

MSDS

Click to get detail MSDS

Toxicological Information

CHEMICAL IDENTIFICATION

RTECS NUMBER :
AM0210000
CHEMICAL NAME :
Acetonitrile, (p-fluorophenyl)-
CAS REGISTRY NUMBER :
459-22-3
BEILSTEIN REFERENCE NO. :
1907764
LAST UPDATED :
199701
DATA ITEMS CITED :
2
MOLECULAR FORMULA :
C8-H6-F-N
MOLECULAR WEIGHT :
135.15
WISWESSER LINE NOTATION :
NC1R DF

HEALTH HAZARD DATA

ACUTE TOXICITY DATA

TYPE OF TEST :
LD50 - Lethal dose, 50 percent kill
ROUTE OF EXPOSURE :
Intravenous
SPECIES OBSERVED :
Rodent - mouse
DOSE/DURATION :
42 mg/kg
TOXIC EFFECTS :
Details of toxic effects not reported other than lethal dose value
REFERENCE :
CSLNX* U.S. Army Armament Research & Development Command, Chemical Systems Laboratory, NIOSH Exchange Chemicals. (Aberdeen Proving Ground, MD 21010) Volume(issue)/page/year: NX#07881

Safety Information

[ Symbol ]:

GHS07

[ Signal Word ]:
Warning

[ Hazard Statements ]:
H302 + H312 + H332-H315-H319-H335

[ Precautionary Statements ]:
P261-P280-P305 + P351 + P338

[ Personal Protective Equipment ]:
Eyeshields;Faceshields;full-face respirator (US);Gloves;multi-purpose combination respirator cartridge (US);type ABEK (EN14387) respirator filter

[ Hazard Codes ]:
Xn:Harmful;

[ Risk Phrases ]:
R20/21/22

[ Safety Phrases ]:
S26-S36-S24/25-S26/36/37/39

[ RIDADR ]:
UN 3276 6.1/PG 3

[ WGK Germany ]:
3

[ RTECS ]:
AM0210000

[ Packaging Group ]:
III

[ Hazard Class ]:
6.1

[ HS Code ]:
2926909090

Synthetic Route

Click to get detail synthetic route

Precursor & DownStream

Precursor

  • (TRIFLUOROMETHYL)DICHLOROPHOSPHINE
  • 1-Bromo-4-fluorobenzene
  • POTASSIUM CYANIDE
  • 4-Isoxazoleboronic acid pinacol ester
  • 1-Chloro-4-fluorobenzene
  • sodium cyanoacetate
  • Sodium cyanide
  • 4-Fluorobenzyl chloride
  • (E)-6-Methyl-3,5-heptadien-2-one
  • (-)-(R)-N,S-dimethyl-S-phenylsulfoximine

DownStream

  • 2-(4-Fluorophenyl)-1-phenylethanone
  • 4-Cyano-4-(4-fluorophenyl)cyclohexanone
  • 4-Fluorophenylacetic acid
  • 4-Fluorophenylacetyl chloride
  • 4-Fluorophenylacetone
  • Benzeneacetonitrile,4-fluoro-a-(phenylmethylene)-
  • 2-(4-fluorophenyl)-3-phenylpropanenitrile
  • tert-Butyl 4-cyano-4-(4-fluorophenyl)piperidine-1-carboxylate
  • 4-(4-fluorophenyl)-1-methylpiperidine-4-carbonitrile
  • 2-[2-(4-METHYL-PIPERAZIN-1-YL)-ETHOXY]-BENZALDEHYDE

Customs

[ HS Code ]: 2926909090

[ Summary ]:
HS:2926909090 other nitrile-function compounds VAT:17.0% Tax rebate rate:9.0% Supervision conditions:none MFN tariff:6.5% General tariff:30.0%

Articles

Biotransformation of phenylacetonitrile to 2-hydroxyphenylacetic acid by marine fungi.

Mar. Biotechnol. 15(1) , 97-103, (2013)

Marine fungi belonging to the genera Aspergillus, Penicillium, Cladosporium, and Bionectria catalyzed the biotransformation of phenylacetonitrile to 2-hydroxyphenylacetic acid. Eight marine fungi, sel...

Synthesis and pharmacological evaluation of 1-alkyl-N-[2-ethyl-2-(4-fluorophenyl)butyl]piperidine-4-carboxamide derivatives as novel antihypertensive agents.

Bioorg. Med. Chem. 19(18) , 5628-5638, (2011)

We synthesized and evaluated inhibitory activity against T-type Ca(2+) channels for a series of 1-alkyl-N-[2-ethyl-2-(4-fluorophenyl)butyl]piperidine-4-carboxamide derivatives. Structure-activity rela...


More Articles

Related Compounds

  • 4-Fluorobenzonitrile
  • Pentafluorophenol
  • Furan-2-ylmethyl acetate
  • 2-Fluorophenol
  • 4-Bromo-o-cresol
  • Venlafaxine hydrochloride
  • prop-2-en-1-yl N-(azetidin-3-yl)-N-(dimethylsulfamoyl)carbamate
  • 1-[1-(2-Fluoro-5-nitrophenyl)cyclopropyl]ethan-1-amine
  • 1,1-Difluoro-2-methylhept-3-en-2-amine
  • 3-(1H-indazol-3-yl)-2,2-dimethylpropanoic acid
  • rac-[(1R,2R)-2-(2-fluoro-5-methylphenyl)cyclopropyl]methanamine
  • 2-amino-2-(1,4-dimethyl-1H-pyrazol-5-yl)propan-1-ol
  • 2-(4,5-Difluoro-2-nitrophenyl)ethane-1-sulfonyl chloride
  • rac-(1R,3R)-2,2-dimethyl-3-[3-(trifluoromethyl)-1H-pyrazol-4-yl]cyclopropane-1-carboxylic acid
  • Methyl 3-(2-cyclopropyl-1,3-thiazol-4-yl)-3-oxopropanoate
  • rac-(1R,2R)-2-(5-nitropyridin-2-yl)cyclopropan-1-amine
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