Introduction：Basic information about CAS 56531-55-6|3-(4-hydroxyphenyl)adamantane-1-carboxylic acid, including its chemical name, molecular formula, synonyms, physicochemical properties, and safety information, etc.
| Common Name | 3-(4-hydroxyphenyl)adamantane-1-carboxylic acid |
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| CAS Number | 56531-55-6 | Molecular Weight | 272.33900 |
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| Density | 1.336g/cm3 | Boiling Point | 461.4ºC at 760 mmHg |
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| Molecular Formula | C17H20O3 | Melting Point | / |
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| MSDS | / | Flash Point | 247ºC |
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Names
| Name | 3-(4-hydroxyphenyl)adamantane-1-carboxylic acid |
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| Synonym | More Synonyms |
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Chemical & Physical Properties
| Density | 1.336g/cm3 |
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| Boiling Point | 461.4ºC at 760 mmHg |
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| Molecular Formula | C17H20O3 |
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| Molecular Weight | 272.33900 |
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| Flash Point | 247ºC |
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| Exact Mass | 272.14100 |
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| PSA | 57.53000 |
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| LogP | 3.31480 |
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| Index of Refraction | 1.651 |
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| InChIKey | VOIFCTZBZXPLPQ-UHFFFAOYSA-N |
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| SMILES | O=C(O)C12CC3CC(C1)CC(c1ccc(O)cc1)(C3)C2 |
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Toxicological Information
CHEMICAL IDENTIFICATION - RTECS NUMBER :
- YD1990500
- CHEMICAL NAME :
- Tricyclo(3.3.1.1(sup 3,7))decane-1-carboxylic acid, 3-(4-hydroxyphenyl)-
- CAS REGISTRY NUMBER :
- 56531-55-6
- LAST UPDATED :
- 199612
- DATA ITEMS CITED :
- 2
- MOLECULAR FORMULA :
- C17-H20-O3
- MOLECULAR WEIGHT :
- 272.37
HEALTH HAZARD DATAACUTE TOXICITY DATA - TYPE OF TEST :
- LD50 - Lethal dose, 50 percent kill
- ROUTE OF EXPOSURE :
- Oral
- SPECIES OBSERVED :
- Rodent - mouse
- DOSE/DURATION :
- 1 gm/kg
- TOXIC EFFECTS :
- Details of toxic effects not reported other than lethal dose value
- REFERENCE :
- PCJOAU Pharmaceutical Chemistry Journal (English Translation). Translation of KHFZAN. (Plenum Pub. Corp., 233 Spring St., New York, NY 10013) No.1- 1967- Volume(issue)/page/year: 23,760,1989
- TYPE OF TEST :
- LD50 - Lethal dose, 50 percent kill
- ROUTE OF EXPOSURE :
- Intraperitoneal
- SPECIES OBSERVED :
- Rodent - mouse
- DOSE/DURATION :
- 1 gm/kg
- TOXIC EFFECTS :
- Details of toxic effects not reported other than lethal dose value
- REFERENCE :
- RPTOAN Russian Pharmacology and Toxicology (English Translation). Translation of FATOAO. (Euromed Pub., 33, Woodlands Rd., Surbiton, Surrey, UK) V.30- 1967- Volume(issue)/page/year: 52,229,1989
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Safety Information
Customs
| HS Code | 2918290000 |
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| Summary | HS: 2918290000 other carboxylic acids with phenol function but without other oxygen function, their anhydrides, halides, peroxides, peroxyacids and their derivatives Tax rebate rate:9.0% Supervision conditions:AB(certificate of inspection for goods inward,certificate of inspection for goods outward) VAT:17.0% MFN tariff:6.5% General tariff:30.0% |
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Synonyms
| Tricyclo(3.3.1.1(sup 3,7))decane-1-carboxylic acid,3-(4-hydroxyphenyl) |
| 3-(4-Hydroxyphenyl)adamantanecarboxylic acid |
| 3-(4-Hydroxyphenyl)tricyclo(3.3.1.1(sup 3,7))decane-1-carboxylic acid |
| 3-(4-hydroxyphenyl)-1-adamantanecarboxylic acid |
