CAS 105-56-6|Ethyl cyanoacetate

Introduction:Basic information about CAS 105-56-6|Ethyl cyanoacetate, including its chemical name, molecular formula, synonyms, physicochemical properties, and safety information, etc.
Common NameEthyl cyanoacetate
CAS Number105-56-6Molecular Weight113.115
Density1.0±0.1 g/cm3Boiling Point203.6±8.0 °C at 760 mmHg
Molecular FormulaC5H7NO2Melting Point-22 °C
MSDSChineseUSAFlash Point110 ºC
Symbol
GHS07
Signal WordWarning

Names

NameEthyl cyanoacetate
SynonymMore Synonyms

Chemical & Physical Properties

Density1.0±0.1 g/cm3
Boiling Point203.6±8.0 °C at 760 mmHg
Melting Point-22 °C
Molecular FormulaC5H7NO2
Molecular Weight113.115
Flash Point110 ºC
Exact Mass113.047676
PSA50.09000
LogP0.06
Vapour density3.9 (vs air)
Vapour Pressure0.3±0.4 mmHg at 25°C
Index of Refraction1.413
InChIKeyZIUSEGSNTOUIPT-UHFFFAOYSA-N
SMILESCCOC(=O)CC#N
Water Solubility20 g/L (20 ºC)

Toxicological Information

CHEMICAL IDENTIFICATION

RTECS NUMBER :
AG4110000
CHEMICAL NAME :
Acetic acid, cyano-, ethyl ester
CAS REGISTRY NUMBER :
105-56-6
BEILSTEIN REFERENCE NO. :
0605871
LAST UPDATED :
199710
DATA ITEMS CITED :
9
MOLECULAR FORMULA :
C5-H7-N-O2
MOLECULAR WEIGHT :
113.13
WISWESSER LINE NOTATION :
NC1VO2

HEALTH HAZARD DATA

ACUTE TOXICITY DATA

TYPE OF TEST :
LDLo - Lowest published lethal dose
ROUTE OF EXPOSURE :
Oral
SPECIES OBSERVED :
Rodent - rat
DOSE/DURATION :
400 mg/kg
TOXIC EFFECTS :
Details of toxic effects not reported other than lethal dose value
REFERENCE :
85JCAE "Prehled Prumyslove Toxikologie; Organicke Latky," Marhold, J., Prague, Czechoslovakia, Avicenum, 1986 Volume(issue)/page/year: -,921,1986
TYPE OF TEST :
LD50 - Lethal dose, 50 percent kill
ROUTE OF EXPOSURE :
Intraperitoneal
SPECIES OBSERVED :
Rodent - mouse
DOSE/DURATION :
500 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
TYPE OF TEST :
LDLo - Lowest published lethal dose
ROUTE OF EXPOSURE :
Subcutaneous
SPECIES OBSERVED :
Rodent - rabbit
DOSE/DURATION :
1410 mg/kg
TOXIC EFFECTS :
Peripheral Nerve and Sensation - spastic paralysis with or without sensory change Lungs, Thorax, or Respiration - respiratory stimulation
REFERENCE :
AIPTAK Archives Internationales de Pharmacodynamie et de Therapie. (Heymans Institute of Pharmacology, De Pintelaan 185, B-9000 Ghent, Belgium) V.4- 1898- Volume(issue)/page/year: 5,161,1899
TYPE OF TEST :
LD50 - Lethal dose, 50 percent kill
ROUTE OF EXPOSURE :
Subcutaneous
SPECIES OBSERVED :
Rodent - guinea pig
DOSE/DURATION :
1115 mg/kg
TOXIC EFFECTS :
Behavioral - tremor Behavioral - muscle contraction or spasticity Gastrointestinal - nausea or vomiting
REFERENCE :
MELAAD Medicina del Lavoro. Industrial Medicine. (Via S. Barnaba, 8, 20122 Milan, Italy) V.16- 1925- Volume(issue)/page/year: 47,192,1956
TYPE OF TEST :
LDLo - Lowest published lethal dose
ROUTE OF EXPOSURE :
Subcutaneous
SPECIES OBSERVED :
Amphibian - frog
DOSE/DURATION :
4200 mg/kg
TOXIC EFFECTS :
Peripheral Nerve and Sensation - spastic paralysis with or without sensory change Behavioral - tremor Lungs, Thorax, or Respiration - dyspnea
REFERENCE :
AIPTAK Archives Internationales de Pharmacodynamie et de Therapie. (Heymans Institute of Pharmacology, De Pintelaan 185, B-9000 Ghent, Belgium) V.4- 1898- Volume(issue)/page/year: 5,161,1899 *** NIOSH STANDARDS DEVELOPMENT AND SURVEILLANCE DATA *** NIOSH OCCUPATIONAL EXPOSURE SURVEY DATA : NOHS - National Occupational Hazard Survey (1974) NOHS Hazard Code - 83848 No. of Facilities: 21 (estimated) No. of Industries: 1 No. of Occupations: 2 No. of Employees: 62 (estimated) NOES - National Occupational Exposure Survey (1983) NOES Hazard Code - 83848 No. of Facilities: 17 (estimated) No. of Industries: 1 No. of Occupations: 1 No. of Employees: 425 (estimated) No. of Female Employees: 17 (estimated)

Safety Information

Symbol
GHS07
Signal WordWarning
Hazard StatementsH302-H312-H332
Precautionary StatementsP280
Personal Protective EquipmentEyeshields;Faceshields;full-face respirator (US);Gloves;multi-purpose combination respirator cartridge (US);type ABEK (EN14387) respirator filter
Hazard CodesXi:Irritant
Risk PhrasesR36/38
Safety PhrasesS36/37-S37/39-S26
RIDADR3276
WGK Germany1
RTECSAG4110000
Hazard Class6.1
HS Code2926909090

Customs

HS Code2926909090
SummaryHS:2926909090 other nitrile-function compounds VAT:17.0% Tax rebate rate:9.0% Supervision conditions:none MFN tariff:6.5% General tariff:30.0%

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Synonyms

ethyl 2-cyanoacetate
Cyano-acetic acid ethyl ester
Ethyl cyanoacetate
Cyanoacetic acid ethyl ester
UNII:X9N006U0F8
EINECS 203-309-0
Acetic acid, 2-cyano-, ethyl ester
ethyl cyanoethanoate
MFCD00001940
ethyl α-cyanoacetate
acetic acid, cyano-, ethyl ester
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