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Substance Name: Dichloroacetyl chloride
RN: 79-36-7
UNII: 52O60099FY
InChIKey: FBCCMZVIWNDFMO-UHFFFAOYSA-N
Classification Codes
- Mutation Data
- Skin / Eye Irritant
- Tumor Data
Molecular Formula
- C2-H-Cl3-O
Molecular Weight
- 147.3879
- All
- Links to Resources
- Names & Synonyms
- Registry Numbers
- Structure Descriptors
- Toxicity
- Physical Properties
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Names and Synonyms
Name of Substance
- 2,2-Dichloroacetyl chloride
- Dichloroacetyl chloride
Synonyms
- 2,2-Dichloroacetyl chloride
- 4-02-00-00504 (Beilstein Handbook Reference)
- Acetyl chloride, dichloro-
- alpha,alpha-Dichloroacetyl chloride
- BRN 1209426
- CCRIS 6011
- Chlorid kyseliny dichloroctove
- Chlorid kyseliny dichloroctove [Czech]
- Chlorure de dichloracetyle
- Chlorure de dichloracetyle [French]
- Dichloracetyl chloride
- Dichloroacetyl chloride
- Dichloroethanoyl chloride
- EC 201-199-9
- EINECS 201-199-9
- HSDB 5229
- UNII-52O60099FY
Systematic Names
- Acetyl chloride, 2,2-dichloro-
- Acetyl chloride, dichloro-
- Dichloroacetyl chloride
Superlist Names
- Acetyl chloride, dichloro-
- Dichloroacetyl chloride
- Dichloroacetyl chloride [UN1765] [Corrosive]
- UN1765
Registry Numbers
CAS Registry Number
- 79-36-7
FDA UNII
- 52O60099FY
System Generated Number
- 0000079367
Structure Descriptors
InChI
InChI=1S/C2HCl3O/c3-1(4)2(5)6/h1HInChIKey
FBCCMZVIWNDFMO-UHFFFAOYSA-NSmiles
ClC(Cl)Toxicity
| Organism | Test Type | Route | Reported Dose (Normalized Dose) | Effect | Source |
|---|---|---|---|---|---|
| rabbit | LD50 | skin | 650uL/kg (0.65mL/kg) | AMA Archives of Industrial Hygiene and Occupational Medicine. Vol. 4, Pg. 119, 1951. | |
| rat | LCLo | inhalation | 2000ppm/4H (2000ppm) | AMA Archives of Industrial Hygiene and Occupational Medicine. Vol. 4, Pg. 119, 1951. | |
| rat | LD50 | oral | 2460mg/kg (2460mg/kg) | AMA Archives of Industrial Hygiene and Occupational Medicine. Vol. 4, Pg. 119, 1951. |
Physical Properties
| Physical Property | Value | Units | Temp (deg C) | Source |
|---|---|---|---|---|
| Melting Point | < 25 | deg C | EXP | |
| Boiling Point | 108 | deg C | EXP | |
| log P (octanol-water) | -0.040 | (none) | EST | |
| Water Solubility | 8.39E+04 | mg/L | 25 | EST |
| Vapor Pressure | 23 | mm Hg | 25 | EXP |
| Henry's Law Constant | 8.25E-05 | atm-m3/mole | 25 | EST |
| Atmospheric OH Rate Constant | 1.88E-14 | cm3/molecule-sec | 25 | EST |
Physical property data is provided to ChemIDplus by SRC, Inc.