Introduction:Basic information about CAS 25168-26-7|2,4-D isooctyl ester, including its chemical name, molecular formula, synonyms, physicochemical properties, and safety information, etc.
| Common Name | 2,4-D isooctyl ester |
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| CAS Number | 25168-26-7 | Molecular Weight | 333.25000 |
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| Density | 1.15 g/cm3 | Boiling Point | 396.9ºC at 760 mmHg |
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| Molecular Formula | C16H22Cl2O3 | Melting Point | 12ºC |
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| MSDS | / | Flash Point | 48ºC |
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Names
| Name | 6-methylheptyl 2-(2,4-dichlorophenoxy)acetate |
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| Synonym | More Synonyms |
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2,4-D isooctyl ester BiologicalActivity
| Description | 2,4-D isooctyl esteris is a selective herbicide of chlorophenoxy compound with higher boiling point, low volatility, and low drift, which is used to control broadleaf weeds in a variety of settings from crops, lawns, to forests[1]. |
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| Related Catalog | Research Areas >>OthersSignaling Pathways >>Others >>Others |
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| References | [1]. Yan Wang, et al. Preparation and characterization of controlled-release poly(melamine-formaldehyde) microcapsules filled with 2,4-D isooctyl ester, International Journal of Polymeric Materials and Polymeric Biomaterials, 66:18, 963-969. |
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Chemical & Physical Properties
| Density | 1.15 g/cm3 |
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| Boiling Point | 396.9ºC at 760 mmHg |
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| Melting Point | 12ºC |
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| Molecular Formula | C16H22Cl2O3 |
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| Molecular Weight | 333.25000 |
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| Flash Point | 48ºC |
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| Exact Mass | 332.09500 |
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| PSA | 35.53000 |
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| LogP | 5.13180 |
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| Vapour Pressure | 1.65E-06mmHg at 25°C |
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| Index of Refraction | 1.506 |
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| InChIKey | BBPLSOGERZQYQC-UHFFFAOYSA-N |
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| SMILES | CC(C)CCCCCOC(=O)COc1ccc(Cl)cc1Cl |
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| Water Solubility | <0.1 g/100 mL at 21 ºC |
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Toxicological Information
CHEMICAL IDENTIFICATION - RTECS NUMBER :
- AG8575000
- CHEMICAL NAME :
- Acetic acid, (2,4-dichlorophenoxy)-, isooctyl ester
- CAS REGISTRY NUMBER :
- 25168-26-7
- LAST UPDATED :
- 199603
- DATA ITEMS CITED :
- 15
- MOLECULAR FORMULA :
- C16-H22-Cl2-O3
- MOLECULAR WEIGHT :
- 333.28
- WISWESSER LINE NOTATION :
- GR CG DO1VO5Y1&1
HEALTH HAZARD DATAACUTE TOXICITY DATA - TYPE OF TEST :
- LD50 - Lethal dose, 50 percent kill
- ROUTE OF EXPOSURE :
- Oral
- SPECIES OBSERVED :
- Rodent - rat
- DOSE/DURATION :
- 982 mg/kg
- TOXIC EFFECTS :
- Details of toxic effects not reported other than lethal dose value
- TYPE OF TEST :
- LD50 - Lethal dose, 50 percent kill
- ROUTE OF EXPOSURE :
- Administration onto the skin
- SPECIES OBSERVED :
- Rodent - rabbit
- DOSE/DURATION :
- >2 gm/kg
- TOXIC EFFECTS :
- Details of toxic effects not reported other than lethal dose value
- TYPE OF TEST :
- TDLo - Lowest published toxic dose
- ROUTE OF EXPOSURE :
- Oral
- SPECIES OBSERVED :
- Rodent - mouse
- DOSE/DURATION :
- 14 gm/kg/78W-I
- TOXIC EFFECTS :
- Tumorigenic - equivocal tumorigenic agent by RTECS criteria Lungs, Thorax, or Respiration - tumors Liver - tumors
- TYPE OF TEST :
- TDLo - Lowest published toxic dose
- ROUTE OF EXPOSURE :
- Subcutaneous
- SPECIES OBSERVED :
- Rodent - mouse
- DOSE/DURATION :
- 21 mg/kg
- TOXIC EFFECTS :
- Tumorigenic - Carcinogenic by RTECS criteria Blood - tumors
- TYPE OF TEST :
- TDLo - Lowest published toxic dose
- ROUTE OF EXPOSURE :
- Oral
- DOSE :
- 1370 mg/kg
- SEX/DURATION :
- female 6-15 day(s) after conception
- TOXIC EFFECTS :
- Reproductive - Effects on Newborn - live birth index (measured after birth)
- TYPE OF TEST :
- TDLo - Lowest published toxic dose
- ROUTE OF EXPOSURE :
- Oral
- DOSE :
- 302 mg/kg
- SEX/DURATION :
- female 9-12 day(s) after conception
- TOXIC EFFECTS :
- Reproductive - Specific Developmental Abnormalities - musculoskeletal system
- TYPE OF TEST :
- TDLo - Lowest published toxic dose
- ROUTE OF EXPOSURE :
- Oral
- DOSE :
- 188 mg/kg
- SEX/DURATION :
- female 6-15 day(s) after conception
- TOXIC EFFECTS :
- Reproductive - Specific Developmental Abnormalities - homeostasis Reproductive - Effects on Newborn - growth statistics (e.g.%, reduced weight gain)
- TYPE OF TEST :
- TDLo - Lowest published toxic dose
- ROUTE OF EXPOSURE :
- Oral
- DOSE :
- 1131 mg/kg
- SEX/DURATION :
- female 6-15 day(s) after conception
- TOXIC EFFECTS :
- Reproductive - Fertility - post-implantation mortality (e.g. dead and/or resorbed implants per total number of implants)
- TYPE OF TEST :
- TDLo - Lowest published toxic dose
- ROUTE OF EXPOSURE :
- Oral
- DOSE :
- 528 mg/kg
- SEX/DURATION :
- female 8-11 day(s) after conception
- TOXIC EFFECTS :
- Reproductive - Effects on Embryo or Fetus - fetotoxicity (except death, e.g., stunted fetus)
- TYPE OF TEST :
- TDLo - Lowest published toxic dose
- ROUTE OF EXPOSURE :
- Oral
- DOSE :
- 1680 mg/kg
- SEX/DURATION :
- female 7-15 day(s) after conception
- TOXIC EFFECTS :
- Reproductive - Effects on Embryo or Fetus - fetotoxicity (except death, e.g., stunted fetus)
- TYPE OF TEST :
- TDLo - Lowest published toxic dose
- ROUTE OF EXPOSURE :
- Oral
- DOSE :
- 438 mg/kg
- SEX/DURATION :
- female 8-12 day(s) after conception
- TOXIC EFFECTS :
- Reproductive - Effects on Newborn - growth statistics (e.g.%, reduced weight gain)
- TYPE OF TEST :
- TDLo - Lowest published toxic dose
- ROUTE OF EXPOSURE :
- Subcutaneous
- DOSE :
- 1170 mg/kg
- SEX/DURATION :
- female 6-14 day(s) after conception
- TOXIC EFFECTS :
- Reproductive - Effects on Embryo or Fetus - extra-embryonic structures (e.g., placenta, umbilical cord) Reproductive - Effects on Embryo or Fetus - fetotoxicity (except death, e.g., stunted fetus) Reproductive - Specific Developmental Abnormalities - eye/ear
MUTATION DATA - TYPE OF TEST :
- Sister chromatid exchange
- TEST SYSTEM :
- Human Lymphocyte
- DOSE/DURATION :
- 50 ug/L
- REFERENCE :
- DBABEF Doga Bilim Dergisi, Seri A2: Biyoloji. Natural Science Journal, Series A2. (Turkiye Bilimsel ve Teknik Arastirma Kurumu, Ataturk Bul. No. 221, Kavaklidere, Ankara, Turkey) V.8- 1984- Volume(issue)/page/year: 8,105,1984 *** REVIEWS *** IARC Cancer Review:Animal Inadequate Evidence IMEMDT IARC Monographs on the Evaluation of Carcinogenic Risk of Chemicals to Man. (WHO Publications Centre USA, 49 Sheridan Ave., Albany, NY 12210) V.1- 1972- Volume(issue)/page/year: 15,111,1977 *** NIOSH STANDARDS DEVELOPMENT AND SURVEILLANCE DATA *** NIOSH OCCUPATIONAL EXPOSURE SURVEY DATA : NOHS - National Occupational Hazard Survey (1974) NOHS Hazard Code - 82947 No. of Facilities: 100 (estimated) No. of Industries: 4 No. of Occupations: 5 No. of Employees: 291 (estimated)
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Safety Information
| Hazard Codes | T:Toxic; |
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| Risk Phrases | R25;R36/38;R40 |
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| Safety Phrases | S26-S36/37-S45 |
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| RIDADR | UN 2810 |
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| RTECS | AG8575000 |
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| Packaging Group | III |
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| Hazard Class | 6.1(b) |
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Synonyms
| 6-Methylheptyl (2,4-dichlorophenoxy)acetate |
| Esteron GE |
| Silvapron D |
| Acetic acid,(2,4-dichlorophenoxy)-,isooctyl ester |
| Agro-D-Ester |
| EINECS 246-704-3 |
| 2,4-D isooctyl ester |
| Agroxone 5 |
| 2,4,6-TRIS-(TRIFLUOROMETHYL)BENZIMIDAZOLE |
| Weedtrine-II |
| MFCD00137356 |
| Herbate Ester 80 |