(4-Methoxyphenyl)acetonitrile
Names
[ CAS No. ]:
104-47-2
[ Name ]:
(4-Methoxyphenyl)acetonitrile
[Synonym ]:
EINECS 203-206-0
(4-Methoxyphenyl)acetonitrile
2-(4-methoxyphenyl)acetonitrile
(4-Methoxyphenyl) acetonitrile
Benzeneacetonitrile, 4-methoxy-
4-Methoxybenzyl cyanide
MFCD00001919
Chemical & Physical Properties
[ Density]:
1.1±0.1 g/cm3
[ Boiling Point ]:
286.5±0.0 °C at 760 mmHg
[ Melting Point ]:
8 °C
[ Molecular Formula ]:
C9H9NO
[ Molecular Weight ]:
147.174
[ Flash Point ]:
112.0±14.3 °C
[ Exact Mass ]:
147.068420
[ PSA ]:
33.02000
[ LogP ]:
1.36
[ Vapour Pressure ]:
0.0±0.6 mmHg at 25°C
[ Index of Refraction ]:
1.519
MSDS
Toxicological Information
CHEMICAL IDENTIFICATION
- RTECS NUMBER :
- AM0810000
- CHEMICAL NAME :
- Acetonitrile, (p-methoxyphenyl)-
- CAS REGISTRY NUMBER :
- 104-47-2
- BEILSTEIN REFERENCE NO. :
- 0509162
- LAST UPDATED :
- 199701
- DATA ITEMS CITED :
- 2
- MOLECULAR FORMULA :
- C9-H9-N-O
- MOLECULAR WEIGHT :
- 147.19
- WISWESSER LINE NOTATION :
- NC1R DO1
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 :
- 56 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#07882
Safety Information
[ Symbol ]:
GHS06
[ Signal Word ]:
Danger
[ Hazard Statements ]:
H301
[ Precautionary Statements ]:
P301 + P310
[ 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-S37/39-S36/37-S61-S45
[ RIDADR ]:
UN 3276 6.1/PG 3
[ WGK Germany ]:
3
[ RTECS ]:
AM0810000
[ Packaging Group ]:
III
[ Hazard Class ]:
6.1
[ HS Code ]:
29269095
Synthetic Route
Precursor & DownStream
Precursor
DownStream
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
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We have investigated halogen-substituted non-steroidal estrogens with selective binding affinity for the estrogen receptor beta (ERbeta that might be used for imaging the levels of this ER-subtype in ...
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2-Alkylidenethiazolidine-4,5-diones were prepared by novel one-pot cyclizations of arylacetonitriles with isothiocyanates and ethyl 2-chloro-2-oxoacetate. The products show antibiotic activity against...
Brominated benzeneacetonitriles, the dibromotyrosine metabolites from the sponge Psammaplysilla purpurea. Venkateswarlu Y and Chavakula R.J. Nat. Prod. 58(7) , 1087-88, (1995)