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| Name |
N,N'-Hexamethylenebis(2,2-dichloro-N-ethylacetamide) |
EINECS | N/A |
| CAS No. | 3613-89-6 | Density | 1.4671 (rough estimate) |
| PSA | 40.62000 | LogP | 3.85120 |
| Solubility | N/A | Melting Point |
N/A |
| Formula | C14H24Cl4N2O2 | Boiling Point | N/A |
| Molecular Weight | 394.20 | Flash Point | N/A |
| Transport Information | N/A | Appearance | N/A |
| Safety | Moderately toxic by intraperitoneal route. Human reproductive effects by ingestion: impaired spermatogenesis. Experimental reproductive effects. Mutation data reported. When heated to decomposition it emits toxic fumes of Cl− and NOx. | Risk Codes | N/A |
| Molecular Structure |
|
Hazard Symbols | N/A |
| Synonyms |
N/A |
N,N'-Hexamethylenebis(2,2-dichloro-N-ethylacetamide) Chemical Properties
Product Name: N,N'-Hexamethylenebis(2,2-dichloro-N-ethylacetamide) (CAS NO.3613-89-6)
Molecular Formula: C14H24Cl4N2O2
Molecular Weight: 394.20g/mol
Mol File: 3613-89-6.mol
Boiling point: 463.3 °C at 760 mmHg
Flash Point: 234 °C
Density: 1.252 g/cm3
Surface Tension: 41.6 dyne/cm
Enthalpy of Vaporization: 72.45 kJ/mol
Vapour Pressure: 9.19E-09 mmHg at 25°C
XLogP3-AA: 4.1
H-Bond Donor: 0
H-Bond Acceptor: 2
Structure Descriptors of N,N'-Hexamethylenebis(2,2-dichloro-N-ethylacetamide) (CAS NO.3613-89-6):
IUPAC Name: 2,2-dichloro-N-[6-[(2,2-dichloroacetyl)-ethylamino]hexyl]-N-ethylacetamide
Canonical SMILES: CCN(CCCCCCN(CC)C(=O)C(Cl)Cl)C(=O)C(Cl)Cl
InChI: InChI=1S/C14H24Cl4N2O2/c1-3-19(13(21)11(15)16)9-7-5-6-8-10-20(4-2)14(22)12(17)18/h11-12H,3-10H2,1-2H3
InChIKey: IFMHJVAKBSKZFN-UHFFFAOYSA-N
N,N'-Hexamethylenebis(2,2-dichloro-N-ethylacetamide) Toxicity Data With Reference
| Organism | Test Type | Route | Reported Dose (Normalized Dose) | Effect | Source |
|---|---|---|---|---|---|
| mouse | LD50 | intraperitoneal | 4400mg/kg (4400mg/kg) | Antibiotics and Chemotherapy Vol. 11, Pg. 245, 1961. | |
| mouse | LD50 | oral | > 16gm/kg (16000mg/kg) | Toxicology and Applied Pharmacology. Vol. 2, Pg. 715, 1960. |
N,N'-Hexamethylenebis(2,2-dichloro-N-ethylacetamide) Consensus Reports
EPA Genetic Toxicology Program.
N,N'-Hexamethylenebis(2,2-dichloro-N-ethylacetamide) Safety Profile
Moderately toxic by intraperitoneal route. Human reproductive effects by ingestion: impaired spermatogenesis. Experimental reproductive effects. Mutation data reported. When heated to decomposition it emits toxic fumes of Cl− and NOx.
N,N'-Hexamethylenebis(2,2-dichloro-N-ethylacetamide) Specification
N,N'-Hexamethylenebis(2,2-dichloro-N-ethylacetamide) ,its CAS NO. is 3613-89-6,the synonyms is BRN 2149708 ; N,N'-Bis(dichloroacetyl)-N,N'-diethyl-1,6-hexanediamine ; WIN 17,416 ; Acetamide, N,N'-hexamethylenebis(2,2-dichloro-N-ethyl- .
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