Introduction：Basic information about CAS 3861-47-0|ioxynil octanoate, including its chemical name, molecular formula, synonyms, physicochemical properties, and safety information, etc.
| Common Name | ioxynil octanoate |
|---|
| CAS Number | 3861-47-0 | Molecular Weight | 497.11000 |
|---|
| Density | 1.81g/cm3 | Boiling Point | 469.5ºC at 760mmHg |
|---|
| Molecular Formula | C15H17I2NO2 | Melting Point | 52-62ºC |
|---|
| MSDS | ChineseUSA | Flash Point | 237.8ºC |
|---|
| Symbol |
GHS06, GHS08, GHS09 | Signal Word | Danger |
|---|
Names
| Name | ioxynil octanoate |
|---|
| Synonym | More Synonyms |
|---|
Chemical & Physical Properties
| Density | 1.81g/cm3 |
|---|
| Boiling Point | 469.5ºC at 760mmHg |
|---|
| Melting Point | 52-62ºC |
|---|
| Molecular Formula | C15H17I2NO2 |
|---|
| Molecular Weight | 497.11000 |
|---|
| Flash Point | 237.8ºC |
|---|
| Exact Mass | 496.93500 |
|---|
| PSA | 50.09000 |
|---|
| LogP | 5.03338 |
|---|
| InChIKey | QBEXFUOWUYCXNI-UHFFFAOYSA-N |
|---|
| SMILES | CCCCCCCC(=O)Oc1c(I)cc(C#N)cc1I |
|---|
| Storage condition | 0-6°C |
|---|
Toxicological Information
CHEMICAL IDENTIFICATION - RTECS NUMBER :
- RH0410000
- CHEMICAL NAME :
- Octanoic acid, (4-cyano-2,6-diiodo)phenyl ester
- CAS REGISTRY NUMBER :
- 3861-47-0
- LAST UPDATED :
- 199612
- DATA ITEMS CITED :
- 8
- MOLECULAR FORMULA :
- C15-H17-I2-N-O2
- MOLECULAR WEIGHT :
- 497.13
- WISWESSER LINE NOTATION :
- NCR CI EI DOV7
HEALTH HAZARD DATAACUTE TOXICITY DATA - TYPE OF TEST :
- LD50 - Lethal dose, 50 percent kill
- ROUTE OF EXPOSURE :
- Oral
- SPECIES OBSERVED :
- Rodent - rat
- DOSE/DURATION :
- 190 mg/kg
- TOXIC EFFECTS :
- Details of toxic effects not reported other than lethal dose value
- TYPE OF TEST :
- LC50 - Lethal concentration, 50 percent kill
- ROUTE OF EXPOSURE :
- Inhalation
- SPECIES OBSERVED :
- Rodent - rat
- DOSE/DURATION :
- >2400 mg/m3
- 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 - rat
- DOSE/DURATION :
- 500 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 :
- Oral
- SPECIES OBSERVED :
- Rodent - mouse
- DOSE/DURATION :
- 205 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 - mouse
- DOSE/DURATION :
- 1240 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 :
- Oral
- SPECIES OBSERVED :
- Bird - wild bird species
- DOSE/DURATION :
- 1 gm/kg
- TOXIC EFFECTS :
- Details of toxic effects not reported other than lethal dose value
MUTATION DATA - TYPE OF TEST :
- DNA repair
- TEST SYSTEM :
- Bacteria - Bacillus subtilis
- DOSE/DURATION :
- 20 ug/disc
- REFERENCE :
- MUREAV Mutation Research. (Elsevier Science Pub. B.V., POB 211, 1000 AE Amsterdam, Netherlands) V.1- 1964- Volume(issue)/page/year: 40,19,1976
|
Safety Information
| Symbol |
GHS06, GHS08, GHS09 |
|---|
| Signal Word | Danger |
|---|
| Hazard Statements | H301 + H311-H317-H319-H361-H410 |
|---|
| Precautionary Statements | P201-P273-P280-P301 + P310 + P330-P302 + P352 + P312-P501 |
|---|
| Personal Protective Equipment | Eyeshields;Faceshields;full-face particle respirator type N100 (US);Gloves;respirator cartridge type N100 (US);type P1 (EN143) respirator filter;type P3 (EN 143) respirator cartridges |
|---|
| Hazard Codes | T,N |
|---|
| Risk Phrases | R25 |
|---|
| Safety Phrases | S26;S45;S60;S61;S36/S37 |
|---|
| RIDADR | UN 2811 |
|---|
| RTECS | RH0410000 |
|---|
| Packaging Group | III |
|---|
| Hazard Class | 6.1(b) |
|---|
| HS Code | 2926909032 |
|---|
Customs
| HS Code | 2926909032 |
|---|
| Summary | 2926909032 o-(4-cyanophenyl) o,o-dimethyl phosphorothioate。supervision conditions:s(import or export registration certificate for pesticides)。VAT:17.0%。tax rebate rate:9.0%。MFN tarrif:6.5%。general tariff:30.0% |
|---|
Synonyms
| ioxynil-octanoacetate |
| MFCD00129668 |
| 3,5-Diiodo-4-hydroxybenzonitrile octanoate |
| Ioxynil octanoate |
| 2,6-Dijod-4-cyanophenyl-oktanoat |
| EINECS 223-375-4 |
| 2,6-diiodo-4-cyanophenyl n-octanoate |
| Benzonitrile,3,5-diiodo-4-hydroxy-,octanoate |
| 3,5-Diiodo-4-octanoyloxybenzonitrile |
| 4-cyano-2,6-diiodophenyl octanoate |
| (4-cyano-2,6-diiodophenyl) octanoate |
