(4-Methoxyphenyl)acetonitrile

Modify Date: 2025-08-22 10:25:10

(4-Methoxyphenyl)acetonitrile Structure
(4-Methoxyphenyl)acetonitrile structure
Common Name (4-Methoxyphenyl)acetonitrile
CAS Number 104-47-2 Molecular Weight 147.174
Density 1.1±0.1 g/cm3 Boiling Point 286.5±0.0 °C at 760 mmHg
Molecular Formula C9H9NO Melting Point 8 °C
MSDS Chinese USA Flash Point 112.0±14.3 °C
Symbol GHS06
GHS06
Signal Word Danger

 Names

Name 4-Methoxyphenylacetonitrile
Synonym More Synonyms

 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

 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
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

 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%

 Articles3

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Bioorg. Med. Chem. 13(14) , 4402-7, (2005)

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J. Nat. Prod. 58(7) , 1087-88, (1995)

 Synonyms

EINECS 203-206-0
(4-Methoxyphenyl)acetonitrile
2-(4-methoxyphenyl)acetonitrile
(4-Methoxyphenyl) acetonitrile
Benzeneacetonitrile, 4-methoxy-
4-Methoxybenzyl cyanide
MFCD00001919
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