|
|
|
Substance Name: Ethyl chloroacetate
RN: 105-39-5
UNII: 6H07TEH4TF
InChIKey: VEUUMBGHMNQHGO-UHFFFAOYSA-N
Classification Codes
- Skin / Eye Irritant
- Tumor Data
Molecular Formula
- C4-H7-Cl-O2
Molecular Weight
- 122.5503
- All
- Links to Resources
- Names & Synonyms
- Registry Numbers
- Structure Descriptors
- Toxicity
- Physical Properties
* denotes mobile formatted website
Links to Resources
NLM Resources (File Locators)
Regulatory Agencies (Superlist Locators)
Other Resources (Internet Locators)
Search for this InChIKey on the Web
Names and Synonyms
Name of Substance
- Ethyl chloroacetate
- Ethyl monochloroacetate
Synonyms
- 4-02-00-00481 (Beilstein Handbook Reference)
- Acetic acid, chloro-, ethyl ester
- AI3-19743
- BRN 0506455
- CCRIS 7747
- Chloroacetic acid, ethyl ester
- EC 203-294-0
- EINECS 203-294-0
- Ethyl alpha-chloroacetate
- Ethyl chloracetate
- Ethyl chloroacetate
- Ethyl chloroethanoate
- Ethyl monochloracetate
- Ethyl monochloroacetate
- Ethylester kyseliny chloroctove
- Ethylester kyseliny chloroctove [Czech]
- HSDB 408
- NSC 8833
- UNII-6H07TEH4TF
Systematic Names
- Acetic acid, 2-chloro-, ethyl ester
- Acetic acid, chloro-, ethyl ester
- Chloroacetic acid ethyl ester
- Ethyl chloroacetate
Superlist Names
- Acetic acid, chloro-, ethyl ester
- Ethyl chloroacetate
- Ethyl chloroacetate [UN1181] [Poison]
- UN1181
Registry Numbers
CAS Registry Number
- 105-39-5
FDA UNII
- 6H07TEH4TF
System Generated Number
- 0000105395
Structure Descriptors
InChI
1S/C4H7ClO2/c1-2-7-4(6)3-5/h2-3H2,1H3InChIKey
VEUUMBGHMNQHGO-UHFFFAOYSA-NSmiles
C(=O)Toxicity
| Organism | Test Type | Route | Reported Dose (Normalized Dose) | Effect | Source |
|---|---|---|---|---|---|
| mouse | LD50 | oral | 350mg/kg (350mg/kg) | Gigiena Truda i Professional'nye Zabolevaniya. Labor Hygiene and Occupational Diseases. Vol. 30(5), Pg. 59, 1986. | |
| mouse | LD50 | subcutaneous | 250mg/kg (250mg/kg) | LUNGS, THORAX, OR RESPIRATION: OTHER CHANGES LUNGS, THORAX, OR RESPIRATION: RESPIRATORY STIMULATION PERIPHERAL NERVE AND SENSATION: FLACCID PARALYSIS WITHOUT ANESTHESIA (USUALLY NEUROMUSCULAR BLOCKAGE) | Japanese Journal of Pharmacology. Vol. 3, Pg. 99, 1954. |
| rabbit | LD50 | skin | 230mg/kg (230mg/kg) | Toxicology and Applied Pharmacology. Vol. 42, Pg. 417, 1977. | |
| rat | LC50 | inhalation | 3330uL/m3/4H (3.33mL/m3) | BEHAVIORAL: TREMOR SENSE ORGANS AND SPECIAL SENSES: OTHER: EYE LUNGS, THORAX, OR RESPIRATION: DYSPNEA | BG Chemie: Toxicological Evaluations, Five Potential Health Hazards of Existing Chemicals. Vol. 5, Pg. 71, 1993. |
| rat | LD50 | oral | 180mg/kg (180mg/kg) | BEHAVIORAL: ATAXIA SKIN AND APPENDAGES (SKIN): HAIR: OTHER BEHAVIORAL: SOMNOLENCE (GENERAL DEPRESSED ACTIVITY) | BG Chemie: Toxicological Evaluations, Five Potential Health Hazards of Existing Chemicals. Vol. 5, Pg. 71, 1993. |
| rat | LD50 | skin | 161mg/kg (161mg/kg) | SKIN AND APPENDAGES (SKIN): HAIR: OTHER BEHAVIORAL: "HALLUCINATIONS, DISTORTED PERCEPTIONS" SENSE ORGANS AND SPECIAL SENSES: LACRIMATION: EYE | BG Chemie: Toxicological Evaluations, Five Potential Health Hazards of Existing Chemicals. Vol. 5, Pg. 71, 1993. |
Physical Properties
| Physical Property | Value | Units | Temp (deg C) | Source |
|---|---|---|---|---|
| Melting Point | -2.10E+01 | deg C | EXP | |
| Boiling Point | 144.3 | deg C | EXP | |
| log P (octanol-water) | 0.94 | (none) | EXP | |
| Water Solubility | 1.94E+04 | mg/L | 30 | EXP |
| Vapor Pressure | 4.87 | mm Hg | 25 | EXP |
| Henry's Law Constant | 4.06E-05 | atm-m3/mole | 25 | EST |
| Atmospheric OH Rate Constant | 1.21E-12 | cm3/molecule-sec | 25 | EST |
Physical property data is provided to ChemIDplus by SRC, Inc.