3-Ethoxyacrylonitrile
Names
[ CAS No. ]:
61310-53-0
[ Name ]:
3-Ethoxyacrylonitrile
[Synonym ]:
MFCD00010193
2-Propenenitrile, 3-ethoxy-
3-Ethoxyprop-2-enenitrile
EINECS 262-706-7
trans-3-ethoxyacrylonitrile
3-Aethoxy-acrylonitril
3-ethoxy-acrylonitrile
3-ethoxy-acrylonitril
3-Ethoxyacrylonitrile
3-ETHOXYPROPENENITRILE
3-Ethoxyacry
3-EAN
usafkf-27
Chemical & Physical Properties
[ Density]:
0.9±0.1 g/cm3
[ Boiling Point ]:
196.9±0.0 °C at 760 mmHg
[ Molecular Formula ]:
C5H7NO
[ Molecular Weight ]:
97.115
[ Flash Point ]:
81.7±0.0 °C
[ Exact Mass ]:
97.052765
[ PSA ]:
33.02000
[ LogP ]:
0.66
[ Vapour Pressure ]:
0.4±0.3 mmHg at 25°C
[ Index of Refraction ]:
1.429
[ Water Solubility ]:
19 g/L (20 ºC)
MSDS
Toxicological Information
CHEMICAL IDENTIFICATION
- RTECS NUMBER :
- AT6475000
- CHEMICAL NAME :
- Acrylonitrile, 3-ethoxy-
- CAS REGISTRY NUMBER :
- 61310-53-0
- BEILSTEIN REFERENCE NO. :
- 1743219
- LAST UPDATED :
- 199612
- DATA ITEMS CITED :
- 1
- MOLECULAR FORMULA :
- C5-H7-N-O
- MOLECULAR WEIGHT :
- 97.13
- WISWESSER LINE NOTATION :
- NC1U1O2
HEALTH HAZARD DATA
ACUTE TOXICITY DATA
- TYPE OF TEST :
- LD50 - Lethal dose, 50 percent kill
- ROUTE OF EXPOSURE :
- Intraperitoneal
- SPECIES OBSERVED :
- Rodent - mouse
- DOSE/DURATION :
- 100 mg/kg
- TOXIC EFFECTS :
- Details of toxic effects not reported other than lethal dose value
- REFERENCE :
- NTIS** National Technical Information Service. (Springfield, VA 22161) Formerly U.S. Clearinghouse for Scientific & Technical Information. Volume(issue)/page/year: AD277-689
Safety Information
[ Symbol ]:
GHS07
[ Signal Word ]:
Warning
[ Hazard Statements ]:
H315-H319-H335
[ Precautionary Statements ]:
P261-P305 + P351 + P338
[ Personal Protective Equipment ]:
Eyeshields;full-face respirator (US);Gloves;multi-purpose combination respirator cartridge (US);type ABEK (EN14387) respirator filter
[ Hazard Codes ]:
Xn:Harmful;
[ Risk Phrases ]:
R10;R22
[ Safety Phrases ]:
S26-S36-S16
[ RIDADR ]:
3276
[ WGK Germany ]:
1
[ RTECS ]:
AT6475000
[ Packaging Group ]:
I; II; III
[ HS Code ]:
2926909090
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
Chem. Res. Toxicol. 18(8) , 1211-8, (2005)
A discussion of nitrosative deamination of cytosine 1 is presented that argues for the formation of 6 by diazotization of 1 to cytosinediazonium ion 2 and its electrostatic complex 3, dediazoniation t...
Heck reactions of 2-substituted enol ethers with aryl bromides catalysed by a tetraphosphine/palladium complex. Battace A, et al.Tetrahedron Lett. 47(4) , 459-62, (2006)