3-ethoxypropanenitrile

Modify Date: 2024-01-04 07:07:19

3-ethoxypropanenitrile Structure
3-ethoxypropanenitrile structure
 Common Name 3-ethoxypropanenitrile
CAS Number 14631-45-9 Molecular Weight 99.13110
Density 0.891 Boiling Point 171ºC
Molecular Formula C5H9NO Melting Point N/A
MSDS N/A Flash Point 64ºC

 Names

Name 3-ethoxypropanenitrile
Synonym More Synonyms

 Chemical & Physical Properties

Density 0.891
Boiling Point 171ºC
Molecular Formula C5H9NO
Molecular Weight 99.13110
Flash Point 64ºC
Exact Mass 99.06840
PSA 33.02000
LogP 0.93498
Vapour Pressure 0.219mmHg at 25°C
Index of Refraction 1.414

 Toxicological Information

CHEMICAL IDENTIFICATION

RTECS NUMBER :
UG1800000
CHEMICAL NAME :
Propionitrile, 2-ethoxy-
CAS REGISTRY NUMBER :
14631-45-9
BEILSTEIN REFERENCE NO. :
1720500
LAST UPDATED :
199707
DATA ITEMS CITED :
5
MOLECULAR FORMULA :
C5-H9-N-O
MOLECULAR WEIGHT :
99.15
WISWESSER LINE NOTATION :
NC2O2

HEALTH HAZARD DATA

ACUTE TOXICITY DATA

TYPE OF TEST :
LD50 - Lethal dose, 50 percent kill
ROUTE OF EXPOSURE :
Oral
SPECIES OBSERVED :
Rodent - rat
DOSE/DURATION :
2860 mg/kg
TOXIC EFFECTS :
Behavioral - excitement Nutritional and Gross Metabolic - other changes
REFERENCE :
TNICS* Toxicology of New Industrial Chemical Substances. English translation of TPKVAL. (USSR Academy of Medical Sciences, Meditsina, Moscow, USSR) Volume(issue)/page/year: 13,125,1973
TYPE OF TEST :
LD50 - Lethal dose, 50 percent kill
ROUTE OF EXPOSURE :
Oral
SPECIES OBSERVED :
Rodent - mouse
DOSE/DURATION :
2200 mg/kg
TOXIC EFFECTS :
Behavioral - excitement Nutritional and Gross Metabolic - other changes
REFERENCE :
TNICS* Toxicology of New Industrial Chemical Substances. English translation of TPKVAL. (USSR Academy of Medical Sciences, Meditsina, Moscow, USSR) Volume(issue)/page/year: 13,125,1973
TYPE OF TEST :
LD50 - Lethal dose, 50 percent kill
ROUTE OF EXPOSURE :
Oral
SPECIES OBSERVED :
Mammal - species unspecified
DOSE/DURATION :
2865 mg/kg
TOXIC EFFECTS :
Details of toxic effects not reported other than lethal dose value
REFERENCE :
GISAAA Gigiena i Sanitariya. For English translation, see HYSAAV. (V/O Mezhdunarodnaya Kniga, 113095 Moscow, USSR) V.1- 1936- Volume(issue)/page/year: 39(4),86,1974 ** OTHER MULTIPLE DOSE TOXICITY DATA **
TYPE OF TEST :
TCLo - Lowest published toxic concentration
ROUTE OF EXPOSURE :
Inhalation
SPECIES OBSERVED :
Rodent - rat
DOSE/DURATION :
940 mg/m3/17W-I
TOXIC EFFECTS :
Brain and Coverings - recordings from specific areas of CNS Kidney, Ureter, Bladder - urine volume increased Kidney, Ureter, Bladder - other changes in urine composition
REFERENCE :
TNICS* Toxicology of New Industrial Chemical Substances. English translation of TPKVAL. (USSR Academy of Medical Sciences, Meditsina, Moscow, USSR) Volume(issue)/page/year: 13,125,1978 *** OCCUPATIONAL EXPOSURE LIMITS *** OEL-RUSSIA:STEL 50 mg/m3 JAN 1993

 Safety Information

HS Code 2926909090

 Synthetic Route

1-chloro-1-ethoxyethane structure

1-chloro-1-etho...

CAS#:7081-78-9

Trimethylsilyl cyanide structure

Trimethylsilyl ...

CAS#:7677-24-9

~86%

3-ethoxypropanenitrile Structure

3-ethoxypropane...

CAS#:14631-45-9

Literature: Reetz, Manfred T.; Chatziiosifidis, Ioannis; Kuenzer, Hermann; Mueller-Starke, Hans Tetrahedron, 1983 , vol. 39, # 6 p. 961 - 966
1,1-Diethoxyethane structure

1,1-Diethoxyethane

CAS#:105-57-7

Trimethylsilyl cyanide structure

Trimethylsilyl ...

CAS#:7677-24-9

~96%

3-ethoxypropanenitrile Structure

3-ethoxypropane...

CAS#:14631-45-9

Literature: Utimoto, Kiitiro; Wakabayashi, Yukio; Horiie,Takafumi; Inoue, Masaharu; Shishiyama, Yuho; et al. Tetrahedron, 1983 , vol. 39, # 6 p. 967 - 974
HYDROGEN CYANIDE structure

HYDROGEN CYANIDE

CAS#:74-90-8

Ethoxyethene structure

Ethoxyethene

CAS#:109-92-2

~%

3-ethoxypropanenitrile Structure

3-ethoxypropane...

CAS#:14631-45-9

Literature: DE749054 , ; DRP/DRBP Org.Chem.
Diethyl ether structure

Diethyl ether

CAS#:60-29-7

Cyanogen chloride structure

Cyanogen chloride

CAS#:506-77-4

~%

3-ethoxypropanenitrile Structure

3-ethoxypropane...

CAS#:14631-45-9

Literature: Bulletin de la Societe Chimique de France, , vol. <3>13, p. 232 Annales de Chimie (Cachan, France), , vol. <7>12, p. 234
2-ethoxypropanamide structure

2-ethoxypropanamide

CAS#:22543-22-2

~%

3-ethoxypropanenitrile Structure

3-ethoxypropane...

CAS#:14631-45-9

Literature: Bulletin de la Societe Chimique de France, , vol. <3>13, p. 232 Annales de Chimie (Cachan, France), , vol. <7>12, p. 234
1-chloro-1-ethoxyethane structure

1-chloro-1-etho...

CAS#:7081-78-9

~%

3-ethoxypropanenitrile Structure

3-ethoxypropane...

CAS#:14631-45-9

Literature: Annales de Chimie (Cachan, France), , vol. <8>16, p. 318
1,1-Diethoxyethane structure

1,1-Diethoxyethane

CAS#:105-57-7

acetyl cyanide structure

acetyl cyanide

CAS#:631-57-2

~%

3-ethoxypropanenitrile Structure

3-ethoxypropane...

CAS#:14631-45-9

Literature: Chemische Berichte, , vol. 95, p. 1859 - 1862
thf structure

thf

CAS#:109-99-9

Pyridine structure

Pyridine

CAS#:110-86-1

Ethoxyethene structure

Ethoxyethene

CAS#:109-92-2

~%

3-ethoxypropanenitrile Structure

3-ethoxypropane...

CAS#:14631-45-9

Literature: DE854504 , ; Justus Liebigs Annalen der Chemie, , vol. 601, p. 81,104

 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

3-ethoxy-propionitrile
3-Ethoxypropiononitrile
Aethylaethermilchsaeure-nitril
Propionitrile,3-ethoxy
O-Aethyl-milchsaeure-nitril
2-ethoxy-propionitrile
1-Cyanoethyl ethyl ether
2-Aethoxy-propionitril
Propionitrile,2-ethoxy
2-ethoxy-propanenitrile
Propanenitrile,3-ethoxy
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