5-FLUORO-2-NITROPHENYLACETONITRILE

Modify Date: 2024-01-02 17:45:44

5-FLUORO-2-NITROPHENYLACETONITRILE Structure
5-FLUORO-2-NITROPHENYLACETONITRILE structure
Common Name 5-FLUORO-2-NITROPHENYLACETONITRILE
CAS Number 3456-75-5 Molecular Weight 180.13600
Density 1.367g/cm3 Boiling Point 303.6ºC at 760mmHg
Molecular Formula C8H5FN2O2 Melting Point 70-72ºC
MSDS N/A Flash Point 137.4ºC

 Names

Name 2-(5-fluoro-2-nitrophenyl)acetonitrile
Synonym More Synonyms

 Chemical & Physical Properties

Density 1.367g/cm3
Boiling Point 303.6ºC at 760mmHg
Melting Point 70-72ºC
Molecular Formula C8H5FN2O2
Molecular Weight 180.13600
Flash Point 137.4ºC
Exact Mass 180.03400
PSA 69.61000
LogP 2.32318
Index of Refraction 1.554

 Toxicological Information

CHEMICAL IDENTIFICATION

RTECS NUMBER :
AM0200000
CHEMICAL NAME :
Acetonitrile, 2-(5-fluoro-2-nitrophenyl)-
CAS REGISTRY NUMBER :
3456-75-5
LAST UPDATED :
199612
DATA ITEMS CITED :
1
MOLECULAR FORMULA :
C8-H5-F-N2-O2
MOLECULAR WEIGHT :
180.15
WISWESSER LINE NOTATION :
WNR DF B1CN

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 :
100 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#04784

 Safety Information

RIDADR UN3439
Packaging Group III
Hazard Class 6.1
HS Code 2926909090

 Synthetic Route

~51%

5-FLUORO-2-NITROPHENYLACETONITRILE Structure

5-FLUORO-2-NITR...

CAS#:3456-75-5

Literature: Makosza, Mieczyslaw; Wenaell, Maria; Golinski, Miroslaw; Kinowski, Andrzej Bulletin of the Polish Academy of Sciences, Chemistry, 1985 , vol. 33, # 9-10 p. 427 - 432

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5-FLUORO-2-NITROPHENYLACETONITRILE Structure

5-FLUORO-2-NITR...

CAS#:3456-75-5

Literature: Journal of Heterocyclic Chemistry, , vol. 2, p. 298 - 299

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5-FLUORO-2-NITROPHENYLACETONITRILE Structure

5-FLUORO-2-NITR...

CAS#:3456-75-5

Literature: Journal of Heterocyclic Chemistry, , vol. 2, p. 298 - 299

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5-FLUORO-2-NITROPHENYLACETONITRILE Structure

5-FLUORO-2-NITR...

CAS#:3456-75-5

Literature: Journal of Heterocyclic Chemistry, , vol. 2, p. 298 - 299

~%

5-FLUORO-2-NITROPHENYLACETONITRILE Structure

5-FLUORO-2-NITR...

CAS#:3456-75-5

Literature: Synlett, , # 16 p. 2435 - 2438

 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%

 Synonyms

Acetonitrile,(5-fluoro-2-nitrophenyl)
5-Fluoro-2-nitrophenylacetonitrile
ACETONITRILE,2-(5-FLUORO-2-NITROPHENYL)
AmbkkkkK707
Benzeneacetonitrile,5-fluoro-2-nitro