1-(p-Tolyl)-3-adamantanecarboxylic acid
Names
[ CAS No. ]:
56531-69-2
[ Name ]:
1-(p-Tolyl)-3-adamantanecarboxylic acid
[Synonym ]:
Tricyclo[3.3.1.1]decane-1-carboxylic acid, 3-(4-methylphenyl)-, (5R,7S)-
1-(p-Tolyl)-3-adamantanecarboxylic acid
1-(p-tolyl)-3-adamantanecarboxylicaci
(1s,3r,5R,7S)-3-(4-Methylphenyl)-1-adamantanecarboxylic acid
tricyclo[3.3.1.1~3,7~]decane-1-carboxylic acid,3-(4-methy
Chemical & Physical Properties
[ Density]:
1.2±0.1 g/cm3
[ Boiling Point ]:
424.3±24.0 °C at 760 mmHg
[ Molecular Formula ]:
C18H22O2
[ Molecular Weight ]:
270.366
[ Flash Point ]:
197.4±17.6 °C
[ Exact Mass ]:
270.161987
[ PSA ]:
37.30000
[ LogP ]:
4.49
[ Vapour Pressure ]:
0.0±1.1 mmHg at 25°C
[ Index of Refraction ]:
1.615
Toxicological Information
CHEMICAL IDENTIFICATION
- RTECS NUMBER :
- AU4454500
- CHEMICAL NAME :
- 3-Adamantanecarboxylic acid, 1-(p-tolyl)-
- CAS REGISTRY NUMBER :
- 56531-69-2
- LAST UPDATED :
- 199612
- DATA ITEMS CITED :
- 1
- MOLECULAR FORMULA :
- C18-H22-O2
- MOLECULAR WEIGHT :
- 270.40
- WISWESSER LINE NOTATION :
- L 66 B6/B-H/DI A B- C 1B ITJ AVQ CR D1
HEALTH HAZARD DATA
ACUTE TOXICITY DATA
- TYPE OF TEST :
- LD50 - Lethal dose, 50 percent kill
- ROUTE OF EXPOSURE :
- Unreported
- SPECIES OBSERVED :
- Rodent - mouse
- DOSE/DURATION :
- 610 mg/kg
- TOXIC EFFECTS :
- Behavioral - anticonvulsant
- 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: 43,73,1980
Safety Information
[ HS Code ]:
2916399090
Synthetic Route
Precursor & DownStream
Precursor
DownStream
Customs
[ HS Code ]: 2916399090
[ Summary ]:
2916399090 other aromatic monocarboxylic 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%