Introduction：Basic information about CAS 1516-17-2|(2E,4E)-2,4-Hexadienyl acetate, including its chemical name, molecular formula, synonyms, physicochemical properties, and safety information, etc.
| Common Name | (2E,4E)-2,4-Hexadienyl acetate |
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| CAS Number | 1516-17-2 | Molecular Weight | 140.180 |
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| Density | 0.9±0.1 g/cm3 | Boiling Point | 186.5±9.0 °C at 760 mmHg |
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| Molecular Formula | C8H12O2 | Melting Point | / |
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| MSDS | USA | Flash Point | 79.6±17.1 °C |
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| Symbol |
GHS05 | Signal Word | Danger |
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Names
| Name | trans,trans-2,4-hexadienyl acetate |
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| Synonym | More Synonyms |
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Chemical & Physical Properties
| Density | 0.9±0.1 g/cm3 |
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| Boiling Point | 186.5±9.0 °C at 760 mmHg |
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| Molecular Formula | C8H12O2 |
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| Molecular Weight | 140.180 |
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| Flash Point | 79.6±17.1 °C |
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| Exact Mass | 140.083725 |
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| PSA | 26.30000 |
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| LogP | 1.91 |
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| Vapour Pressure | 0.7±0.4 mmHg at 25°C |
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| Index of Refraction | 1.454 |
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| InChIKey | PXVKYPFROMBALG-DNVGVPOPSA-N |
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| SMILES | CC=CC=CCOC(C)=O |
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Toxicological Information
CHEMICAL IDENTIFICATION - RTECS NUMBER :
- AI0350000
- CHEMICAL NAME :
- Acetic acid, 2,4-hexadienyl ester
- CAS REGISTRY NUMBER :
- 1516-17-2
- LAST UPDATED :
- 199701
- DATA ITEMS CITED :
- 5
- MOLECULAR FORMULA :
- C8-H12-O2
- MOLECULAR WEIGHT :
- 140.20
- WISWESSER LINE NOTATION :
- 2U2U2OV1
HEALTH HAZARD DATAACUTE TOXICITY DATA - TYPE OF TEST :
- Standard Draize test
- ROUTE OF EXPOSURE :
- Administration onto the skin
- SPECIES OBSERVED :
- Rodent - rabbit
- REFERENCE :
- 85JCAE "Prehled Prumyslove Toxikologie; Organicke Latky," Marhold, J., Prague, Czechoslovakia, Avicenum, 1986 Volume(issue)/page/year: -,360,1986
- TYPE OF TEST :
- Standard Draize test
- ROUTE OF EXPOSURE :
- Administration into the eye
- SPECIES OBSERVED :
- Rodent - rabbit
- REFERENCE :
- 85JCAE "Prehled Prumyslove Toxikologie; Organicke Latky," Marhold, J., Prague, Czechoslovakia, Avicenum, 1986 Volume(issue)/page/year: -,360,1986 ** ACUTE TOXICITY DATA **
- TYPE OF TEST :
- LD50 - Lethal dose, 50 percent kill
- ROUTE OF EXPOSURE :
- Oral
- SPECIES OBSERVED :
- Rodent - rat
- DOSE/DURATION :
- 4360 uL/kg
- TOXIC EFFECTS :
- Details of toxic effects not reported other than lethal dose value
- REFERENCE :
- TXAPA9 Toxicology and Applied Pharmacology. (Academic Press, Inc., 1 E. First St., Duluth, MN 55802) V.1- 1959- Volume(issue)/page/year: 28,313,1974
- TYPE OF TEST :
- LD50 - Lethal dose, 50 percent kill
- ROUTE OF EXPOSURE :
- Administration onto the skin
- SPECIES OBSERVED :
- Rodent - rabbit
- DOSE/DURATION :
- 2520 uL/kg
- TOXIC EFFECTS :
- Details of toxic effects not reported other than lethal dose value
- REFERENCE :
- TXAPA9 Toxicology and Applied Pharmacology. (Academic Press, Inc., 1 E. First St., Duluth, MN 55802) V.1- 1959- Volume(issue)/page/year: 28,313,1974
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Safety Information
| Symbol |
GHS05 |
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| Signal Word | Danger |
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| Hazard Statements | H318 |
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| Precautionary Statements | P280-P305 + P351 + P338 |
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| Personal Protective Equipment | Eyeshields;full-face respirator (US);Gloves;multi-purpose combination respirator cartridge (US);type ABEK (EN14387) respirator filter |
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| Hazard Codes | Xi: Irritant; |
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| Risk Phrases | R36 |
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| Safety Phrases | S26-S39 |
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| WGK Germany | 3 |
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| RTECS | AI0350000 |
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| HS Code | 2942000000 |
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Customs
| HS Code | 2915390090 |
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| Summary | 2915390090. esters of acetic acid. VAT:17.0%. Tax rebate rate:13.0%. Supervision conditions:AB(certificate of inspection for goods inward,certificate of inspection for goods outward). MFN tariff:5.5%. General tariff:30.0% |
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Synonyms
| 2,4-HEXADIENYL ACETATE |
| 2,4-Hexadien-1-ol, acetate, (2E,4E)- |
| T2 T4 HEXADIEN 1YL ACETATE |
| 1-Acetoxy-2,4-hexadiene |
| aceticacid,2,4-hexadienylester |
| MFCD00036521 |
| (2E,4E)-2,4-Hexadienyl acetate |
| 2,4-Hexad |
| 1-Acetoxy-2,4-hexadien |
| SORBYL ACETATE |
| aceticacid,2,4-hexadien-1-olester |
| hexa-2,4-dienyl acetate |
| 1-Acetoxy-hexa-2,4-dien |
| (2E,4E)-Hexa-2,4-dien-1-yl acetate |
| acetic acid hexa-2t,4t-dienyl ester |
| EINECS 216-163-8 |
| Essigsaeure-hexa-2,4-dienylester |
| 1-acetoxy-hexa-2,4-diene |
| 2,4-hexadien-1-ol,acetate |
| E,E-2,4-Hexadienyl acetate |
| trans,trans-2,4-Hexadienyl acetate |
| (2E,4E)-2,4-Hexadien-1-yl acetate |
