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| CAS No.: | 93-71-0 |
|---|---|
| Name: | ALLIDOCHLOR |
| Article Data: | 12 |
| Molecular Structure: | |
|
|
|
| Formula: | C8H12 Cl N O |
| Molecular Weight: | 173.642 |
| Synonyms: | Acetamide,2-chloro-N,N-di-2-propenyl- (9CI); Acetamide, N,N-diallyl-2-chloro- (8CI);2-Chloro-N,N-diallylacetamide; Alidochlor; Alidochlore; Allidochlor; CDAA; CP6,343; N,N-Diallyl-2-chloroacetamide; N,N-Diallyl-a-chloroacetamide; N,N-Diallylchloroacetamide; Randox; a-Chloro-N,N-diallylacetamide |
| EINECS: | 202-270-7 |
| Density: | 1.042 g/cm3 |
| Melting Point: | 145oC |
| Boiling Point: | 241.5 °C at 760 mmHg |
| Flash Point: | 99.8 °C |
| Solubility: | 19.32g/L(25 oC) |
| Hazard Symbols: |
 
|
| Risk Codes: | 21/22-36/38-51/53 |
| Safety: | Poison by skin contact. Moderately toxic by ingestion. An herbicide. When heated to decomposition it emits very toxic fumes of Cl− and NOx. See also ALLYL COMPOUNDS. |
| PSA: | 20.31000 |
| LogP: | 1.42580 |
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Chemistry
Molecular Structure of 2-Chloro-N,N-diallylacetamide (CAS NO.93-71-0):
EINECS: 202-270-7
IUPAC Name: 2-Chloro-N,N-bis(prop-2-enyl)acetamide
Molecular Formula: C8H12ClNO
Molecular Weight: 173.639980 g/mol
XLogP3-AA: 1.6
H-Bond Donor: 0
H-Bond Acceptor: 1
Canonical SMILES: C=CCN(CC=C)C(=O)CCl
InChI: InChI=1S/C8H12ClNO/c1-3-5-10(6-4-2)8(11)7-9/h3-4H,1-2,5-7H2
InChIKey: MDBGGTQNNUOQRC-UHFFFAOYSA-N
Index of Refraction: 1.478
Molar Refractivity: 47.16 cm3
Molar Volume: 166.5 cm3
Surface Tension: 32.5 dyne/cm
Density: 1.042 g/cm3
Flash Point: 99.8 °C
Enthalpy of Vaporization: 47.84 kJ/mol
Boiling Point: 241.5 °C at 760 mmHg
Vapour Pressure: 0.0358 mmHg at 25 °C
Water Solubility: 1760 mg/L at 25 °C
Storage Temp.: 0-6 °C
BRN: 1761616
Toxicity Data With Reference
| 1. | orl-rat LD50:700 mg/kg | RREVAH Residue Reviews. 10 (1965),97. | ||
| 2. | skn-rat LD50:360 mg/kg | WRPCA2 World Review of Pest Control. 9 (1970),119. |
Consensus Reports
Reported in EPA TSCA Inventory.
Safety Profile
Safety Information of 2-Chloro-N,N-diallylacetamide (CAS NO.93-71-0):
Hazard Codes: Xn 
,N 
Risk Statements: 21/22-36/38-51/53
R21/22:Harmful in contact with skin and if swallowed
R36/38:Irritating to eyes and skin
R51/53:Toxic to aquatic organisms, may cause long-term adverse effects in the aquatic environment
Safety Statements: 26-28-36/37/39-61
S26: In case of contact with eyes, rinse immediately with plenty of water and seek medical advice
S28:After contact with skin, wash immediately with plenty of soap-suds
S36/37/39:Wear suitable protective clothing, gloves and eye/face protection
S61:Avoid release to the environment. Refer to special instructions / safety data sheets
RIDADR: 2902
RTECS: AB5250000
HazardClass: 6.1(b)
PackingGroup: III
Poison by skin contact. Moderately toxic by ingestion. An herbicide. When heated to decomposition it emits very toxic fumes of Cl− and NOx. See also ALLYL COMPOUNDS.
Specification
2-Chloro-N,N-diallylacetamide with CAS registry number of 93-71-0 is amber liquid, known as CDAA ; 2-Chloro-N,N-di-2-propenylacetamide ; 4-04-00-01064 (Beilstein Handbook Reference) ; AI3-51490 ; Acetamide, 2-chloro-N,N-di-2-propenyl- ; Acetamide, 2-chloro-N,N-diallyl- ; Acetamide, 2-chloro-N,N-di-2-propen-1-yl- ; Acetamide, N,N-diallyl-2-chloro- ; Acetamide, N,N-diallyl-2-chloro- (8CI) ; Alidochlor ; Alidochlore ; Allidochlor ; Allidochlor [ISO] ; CP 6,343 ; Caswell No. 284 ; Cdaat ; Diallylamid kyseliny chloroctove ; Diallylamid kyseliny chloroctove [Czech] ; Diallylchloroacetamide ; EPA Pesticide Chemical Code 019301 ; HSDB 1560 ; N,N-Diallyl-2-chloroacetamide ; N,N-Diallylchloroacetamide ; NCI-C04035 ; Randox ; Rantox T ; alpha-Chloro-N,N-diallylacetamide .