Introduction：Basic information about CAS 617-54-9|2-Butenedioic acid,2-methyl-, 1,4-dimethyl ester, (2Z)-, including its chemical name, molecular formula, synonyms, physicochemical properties, and safety information, etc.
| Common Name | 2-Butenedioic acid,2-methyl-, 1,4-dimethyl ester, (2Z)- |
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| CAS Number | 617-54-9 | Molecular Weight | 158.15200 |
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| Density | 1.11 g/cm3 | Boiling Point | 211ºC |
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| Molecular Formula | C7H10O4 | Melting Point | / |
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| MSDS | / | Flash Point | 91.5ºC |
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Names
| Name | Dimethyl citraconate |
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| Synonym | More Synonyms |
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Chemical & Physical Properties
| Density | 1.11 g/cm3 |
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| Boiling Point | 211ºC |
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| Molecular Formula | C7H10O4 |
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| Molecular Weight | 158.15200 |
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| Flash Point | 91.5ºC |
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| Exact Mass | 158.05800 |
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| PSA | 52.60000 |
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| LogP | 0.27870 |
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| Index of Refraction | 1.438 |
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| InChIKey | WQEXBUQDXKPVHR-SNAWJCMRSA-N |
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| SMILES | COC(=O)C=C(C)C(=O)OC |
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Toxicological Information
CHEMICAL IDENTIFICATION - RTECS NUMBER :
- GE6700000
- CHEMICAL NAME :
- Citraconic acid, dimethyl ester
- CAS REGISTRY NUMBER :
- 617-54-9
- BEILSTEIN REFERENCE NO. :
- 1723489
- LAST UPDATED :
- 199709
- DATA ITEMS CITED :
- 2
- MOLECULAR FORMULA :
- C7-H10-O4
- MOLECULAR WEIGHT :
- 158.17
- WISWESSER LINE NOTATION :
- 1OVY1&U1VO1
HEALTH HAZARD DATAACUTE TOXICITY DATA - TYPE OF TEST :
- Standard Draize test
- ROUTE OF EXPOSURE :
- Administration onto the skin
- SPECIES OBSERVED :
- Rodent - rabbit
- REFERENCE :
- FCTXAV Food and Cosmetics Toxicology. (London, UK) V.1-19, 1963-81. For publisher information, see FCTOD7. Volume(issue)/page/year: 14,749,1976
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Safety Information
| Risk Phrases | 36/37/38 |
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| HS Code | 2917190090 |
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Customs
| HS Code | 2917190090 |
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| Summary | 2917190090 acyclic polycarboxylic acids, their anhydrides, halides, peroxides, peroxyacids and their derivatives VAT:17.0% Tax rebate rate:9.0% Supervision conditions:none MFN tariff:6.5% General tariff:30.0% |
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Synonyms
| citraconic acid dimethyl ester |
