Introduction：Basic information about CAS 1755-52-8|3-Cyclohexene-1-carboxylicacid, 3-ethyl-4-(4-methoxyphenyl)-2-methyl-, including its chemical name, molecular formula, synonyms, physicochemical properties, and safety information, etc.
| Common Name | 3-Cyclohexene-1-carboxylicacid, 3-ethyl-4-(4-methoxyphenyl)-2-methyl- |
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| CAS Number | 1755-52-8 | Molecular Weight | 274.35500 |
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| Density | 1.081g/cm3 | Boiling Point | 426.1ºC at 760mmHg |
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| Molecular Formula | C17H22O3 | Melting Point | / |
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| MSDS | / | Flash Point | 152.3ºC |
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Names
| Name | 3-ethyl-4-(4-methoxyphenyl)-2-methylcyclohex-3-ene-1-carboxylic acid |
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| Synonym | More Synonyms |
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Chemical & Physical Properties
| Density | 1.081g/cm3 |
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| Boiling Point | 426.1ºC at 760mmHg |
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| Molecular Formula | C17H22O3 |
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| Molecular Weight | 274.35500 |
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| Flash Point | 152.3ºC |
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| Exact Mass | 274.15700 |
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| PSA | 46.53000 |
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| LogP | 3.98950 |
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| Vapour Pressure | 5.09E-08mmHg at 25°C |
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| Index of Refraction | 1.531 |
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| InChIKey | VJKVHUZOVAWKEB-UHFFFAOYSA-N |
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| SMILES | CCC1=C(c2ccc(OC)cc2)CCC(C(=O)O)C1C |
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Toxicological Information
CHEMICAL IDENTIFICATION - RTECS NUMBER :
- GW4430000
- CHEMICAL NAME :
- 3-Cyclohexene-1-carboxylic acid, 3-ethyl-4-(p-methoxyphenyl)-2-methyl-
- CAS REGISTRY NUMBER :
- 1755-52-8
- BEILSTEIN REFERENCE NO. :
- 2653888
- LAST UPDATED :
- 199612
- DATA ITEMS CITED :
- 3
- MOLECULAR FORMULA :
- C17-H22-O3
- MOLECULAR WEIGHT :
- 274.39
- WISWESSER LINE NOTATION :
- L6UTJ AR DO1& B2 C1 DVQ
HEALTH HAZARD DATAACUTE TOXICITY DATA - TYPE OF TEST :
- TDLo - Lowest published toxic dose
- ROUTE OF EXPOSURE :
- Oral
- SPECIES OBSERVED :
- Human
- DOSE/DURATION :
- 126 mg/kg/6W-I
- TOXIC EFFECTS :
- Behavioral - anorexia (human) Gastrointestinal - hypermotility, diarrhea Gastrointestinal - nausea or vomiting
- REFERENCE :
- CCROBU Cancer Chemotherapy Reports, Part 1. (Washington, DC) V.52(6)-59, 1968-75. For publisher information, see CTRRDO. Volume(issue)/page/year: 56,641,1972 ** REPRODUCTIVE DATA **
- TYPE OF TEST :
- TDLo - Lowest published toxic dose
- ROUTE OF EXPOSURE :
- Oral
- DOSE :
- 16 mg/kg
- SEX/DURATION :
- male 8 day(s) pre-mating
- TOXIC EFFECTS :
- Reproductive - Fertility - male fertility index (e.g. # males impregnating females per # males exposed to fertile nonpregnant females)
- REFERENCE :
- JRPFA4 Journal of Reproduction and Fertility. (Biochemical Soc. Book Depot, POB 32, Commerce Way, Colchester, Essex CO2 8HP, UK) V.1- 1960- Volume(issue)/page/year: 12,381,1966
- TYPE OF TEST :
- TDLo - Lowest published toxic dose
- ROUTE OF EXPOSURE :
- Oral
- DOSE :
- 30 ug/kg
- SEX/DURATION :
- female 1 day(s) after conception
- TOXIC EFFECTS :
- Reproductive - Fertility - female fertility index (e.g. # females pregnant per # sperm positive females; # females pregnant per # females mated)
- REFERENCE :
- JPETAB Journal of Pharmacology and Experimental Therapeutics. (Williams & Wilkins Co., 428 E. Preston St., Baltimore, MD 21202) V.1- 1909/10- Volume(issue)/page/year: 167,105,1969
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Safety Information
Customs
| HS Code | 2918990090 |
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| Summary | 2918990090. other carboxylic acids with additional oxygen function and their anhydrides, halides, peroxides and peroxyacids; their halogenated, sulphonated, nitrated or nitrosated derivatives. VAT:17.0%. Tax rebate rate:13.0%. . MFN tariff:6.5%. General tariff:30.0% |
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Synonyms
| 3-Cyclohexene-1-carboxylic acid,3-ethyl-4-(p-methoxyphenyl)-2-methyl |
| ORF 2166 |
| 3-Aethyl-4-(4-methoxy-phenyl)-2-methyl-cyclohex-3-encarbonsaeure |
| 3-Ethyl-4-(p-methoxyphenyl)-2-methyl-3-cyclohexene-1-carboxylic acid |
| U 2911 |
| 3-ethyl-4-(4-methoxy-phenyl)-2-methyl-cyclohex-3-enecarboxylic acid |
| CARBESTROL |
