![Ethyl 2-[benzoyl-(3,4-dichlorophenyl)amino]propanoate structure, CAS 22212-55-1](/structures/40000/38910_1_22212_55_1.png)
CAS Number22212-55-1
Synonymsbenzoylprop ethyl; sd30,053; benzoylprop; Ethyl 2-[benzoyl-(3,4-dichlorophenyl)amino]propanoate; suffix25; Endaven; ethyl N-benzoyl-N-(3,4-dichlorophenyl)-DL-alaninate; MFCD00143676; Endavan; Suffix; Karakhol; ethyl ester of N-benzoyl-N-3,4-dichlorophenylalanine; Enaven; FX 2182; EINECS 244-845-5
Molecular FormulaC18H17Cl2NO3
Molecular Weight366.24
Purity98.00%
Density1.305g/cm3
Boiling Point493.4ºC at 760mmHg
Melting Point60-70ºC
AppearanceCrystalline Powder
EINECS244-845-5
| Chemical & Physical Properties | |
|---|---|
| CAS Number | 22212-55-1 |
| Catalog No. | 2A-9038910 |
| Chinese Name | N-苯甲酰-N-(3,4-二氯苯基)-DL-丙氨酸乙酯 |
| Synonyms | benzoylprop ethyl; sd30,053; benzoylprop; Ethyl 2-[benzoyl-(3,4-dichlorophenyl)amino]propanoate; suffix25; Endaven; ethyl N-benzoyl-N-(3,4-dichlorophenyl)-DL-alaninate; MFCD00143676; Endavan; Suffix; Karakhol; ethyl ester of N-benzoyl-N-3,4-dichlorophenylalanine; Enaven; FX 2182; EINECS 244-845-5 |
| Molecular Formula | C18H17Cl2NO3 |
| Molecular Weight | 366.24 |
| Purity | 98.00 |
| Density | 1.305g/cm3 |
| Boiling Point | 493.4ºC at 760mmHg |
| Melting Point | 60-70ºC |
| Appearance | Crystalline Powder |
| EINECS | 244-845-5 |
| HTC | 2924299013 |
| PubChem ID | 329753780 |
| MDL Number | MFCD00143676 |
| SMILES | CCOC(=O)C(C)N(C(=O)c1ccccc1)c2ccc(Cl)c(Cl)c2 |
| InChI | 1S/C18H17Cl2NO3/c1-3-24-18(23)12(2)21(14-9-10-15(19)16(20)11-14)17(22)13-7-5-4-6-8-13/h4-12H,3H2,1-2H3 |
| InChI Key | SLCGUGMPSUYJAY-UHFFFAOYSA-N |
| Beilstein/REAXYS | 2899940 |
| NACRES Code | NA.24 |
| UNSPSC | 41116107 |
| MSDS | msds/38910_1_22212_55_1.pdf |
| Use of | Properties Name benzoylprop-ethyl Synonym More Synonyms Chemical & Physical Properties Exact Mass 365.05900 PSA 46.61000 LogP 4.59340 Appearance of Characters Crystalline Powder Index of Refraction 1.5688 (20ºC) Toxicological Information CHEMICAL IDENTIFICATION RTECS NUMBER : CHEMICAL NAME : Propionic acid, 2-(N-benzoyl-N-(3,4-dichlorophenyl))amino-, ethyl ester, (+-)- CAS REGISTRY NUMBER : 22212-55-1 LAST UPDATED : DATA ITEMS CITED : MOLECULAR FORMULA : C18-H17-Cl2-N-O3 MOLECULAR WEIGHT : WISWESSER LINE NOTATION : GR BG DNVR&Y1&VO2 HEALTH HAZARD DATA ACUTE TOXICITY DATA TYPE OF TEST : LD50 - Lethal dose, 50 percent kill ROUTE OF EXPOSURE : SPECIES OBSERVED : Rodent - rat DOSE/DURATION : TOXIC EFFECTS : Details of toxic effects not reported other than lethal dose value REFERENCE : GUCHAZ Guide to the Chemicals Used in Crop Protection. (Information Canada, 171 Slater St., Ottawa, Ont., Canada) Volume(issue)/page/year: 6,256,1973 TYPE OF TEST : LD - Lethal dose ROUTE OF EXPOSURE : Administration onto the skin SPECIES OBSERVED : Rodent - rat DOSE/DURATION : TOXIC EFFECTS : Details of toxic effects not reported other than lethal dose value REFERENCE : GTPZAB Gigiena Truda i Professional'nye Zabolevaniya. Labor Hygiene and Occupational Diseases. (V/O Mezhdunarodnaya Kniga, 113095 Moscow, USSR) V.1-36, 1957-1992. For publisher information, see MTPEEI Volume(issue)/page/year: 21(12),30,1977 TYPE OF TEST : LD50 - Lethal dose, 50 percent kill ROUTE OF EXPOSURE : Parenteral SPECIES OBSERVED : Rodent - rat DOSE/DURATION : TOXIC EFFECTS : Details of toxic effects not reported other than lethal dose value REFERENCE : DEVEAA Defense des Vegetaux. (Federation Nationale des Groupements de Protection des Cultures, 149, rue de Bercy, 75595 Paris Cedex, 12, France) V.1- 1947- Volume(issue)/page/year: 26,5,1972 TYPE OF TEST : LD50 - Lethal dose, 50 percent kill ROUTE OF EXPOSURE : SPECIES OBSERVED : Rodent - mouse DOSE/DURATION : TOXIC EFFECTS : Details of toxic effects not reported other than lethal dose value REFERENCE : 85JFAN "Agrochemicals Handbook," with updates, Hartley, D., and H. Kidd, eds., Nottingham, Royal Soc. of Chemistry, 1983-86 Volume(issue)/page/year: A035,1983 TYPE OF TEST : LD50 - Lethal dose, 50 percent kill ROUTE OF EXPOSURE : Unreported SPECIES OBSERVED : Rodent - mouse DOSE/DURATION : TOXIC EFFECTS : Details of toxic effects not reported other than lethal dose value REFERENCE : TGANAK Tsitologiya i Genetika. Cytology and Genetics. For English translation, see CYGEDX. (V/O Mezhdunarodnaya Kniga, 113095 Moscow, USSR) V.1- 1967- Volume(issue)/page/year: 16(1),45,1982 TYPE OF TEST : LD50 - Lethal dose, 50 percent kill ROUTE OF EXPOSURE : SPECIES OBSERVED : Mammal - dog DOSE/DURATION : TOXIC EFFECTS : Details of toxic effects not reported other than lethal dose value REFERENCE : TYPE OF TEST : LD50 - Lethal dose, 50 percent kill ROUTE OF EXPOSURE : SPECIES OBSERVED : Rodent - rabbit DOSE/DURATION : TOXIC EFFECTS : Details of toxic effects not reported other than lethal dose value REFERENCE : TYPE OF TEST : LD - Lethal dose ROUTE OF EXPOSURE : Administration onto the skin SPECIES OBSERVED : Rodent - rabbit DOSE/DURATION : TOXIC EFFECTS : Details of toxic effects not reported other than lethal dose value REFERENCE : GTPZAB Gigiena Truda i Professional'nye Zabolevaniya. Labor Hygiene and Occupational Diseases. (V/O Mezhdunarodnaya Kniga, 113095 Moscow, USSR) V.1-36, 1957-1992. For publisher information, see MTPEEI Volume(issue)/page/year: 21(12),30,1977 TYPE OF TEST : LD50 - Lethal dose, 50 percent kill ROUTE OF EXPOSURE : SPECIES OBSERVED : Rodent - guinea pig DOSE/DURATION : TOXIC EFFECTS : Details of toxic effects not reported other than lethal dose value REFERENCE : TYPE OF TEST : LD50 - Lethal dose, 50 percent kill ROUTE OF EXPOSURE : SPECIES OBSERVED : Bird - domestic DOSE/DURATION : TOXIC EFFECTS : Details of toxic effects not reported other than lethal dose value REFERENCE : PEMNDP Pesticide Manual. (The British Crop Protection Council, 20 Bridport Rd., Thornton Heath CR4 7QG, UK) V.1- 1968- Volume(issue)/page/year: 8,66,1987 Safety Information GHS07, GHS09 Signal Word Warning Hazard Statements H302-H410 Precautionary Statements P273-P501 Personal Protective Equipment dust mask type N95 (US);Eyeshields;Gloves Hazard Codes Xn: Harmful;N: Dangerous for the environment; Risk Phrases R22 Safety Phrases S24;S60;S61 RTECS UE7550000 HS Code 2924299013 Synthetic Route Total: 1 Page ethyl ester of ... CAS#:22212-58-4 Benzoyl chloride CAS#:98-88-4 benzoylprop-ethyl CAS#:22212-55-1 Literature: Antipanova, V. E.; Simonov, V. D.; Savin, V. P.; Sklyar, S. Ya.; Mannanova, S. A. J. Appl. Chem. USSR (Engl. Transl.), 1980 , vol. 53, # 6 p. 1362 - 1367,1090 - 1093 Precursor & DownStream Precursor 2 CAS#:22212-58-4 ethyl ester of ... CAS#:98-88-4 Benzoyl chloride DownStream 0 Preparation |
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