4-tert-pentylcyclohexanone
Names
[ CAS No. ]:
16587-71-6
[ Name ]:
4-tert-pentylcyclohexanone
[Synonym ]:
4-t-pentylcyclohexanone
EINECS 240-642-0
MFCD00013798
4-TERT-PENTYLCYCLOHEXANONE
4-tert-Amylcyclohexanone
p-t-amyl cyclohexanone
4-(tert-Pentyl)cyclohexanone
CYCLOHEXANONE,4-tert-PENTYL
4-(TERT.-PENTYL)-CYCLOHEXANONE
Chemical & Physical Properties
[ Density]:
0.92
[ Boiling Point ]:
124-125°C 16mm
[ Melting Point ]:
96°C
[ Molecular Formula ]:
C11H20O
[ Molecular Weight ]:
168.27600
[ Flash Point ]:
124-125°C/16mm
[ Exact Mass ]:
168.15100
[ PSA ]:
17.07000
[ LogP ]:
3.18190
[ Vapour Pressure ]:
0.0649mmHg at 25°C
[ Index of Refraction ]:
1.4690
MSDS
Toxicological Information
CHEMICAL IDENTIFICATION
- RTECS NUMBER :
- GW1960000
- CHEMICAL NAME :
- Cyclohexanone, 4-tert-pentyl-
- CAS REGISTRY NUMBER :
- 16587-71-6
- BEILSTEIN REFERENCE NO. :
- 2240475
- LAST UPDATED :
- 199701
- DATA ITEMS CITED :
- 4
- MOLECULAR FORMULA :
- C11-H20-O
- MOLECULAR WEIGHT :
- 168.31
- WISWESSER LINE NOTATION :
- L6VTJ DX2&1&1
HEALTH HAZARD DATA
ACUTE 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: 12,819,1974 ** ACUTE TOXICITY DATA **
- TYPE OF TEST :
- LD50 - Lethal dose, 50 percent kill
- ROUTE OF EXPOSURE :
- Oral
- SPECIES OBSERVED :
- Rodent - rat
- DOSE/DURATION :
- 4700 mg/kg
- TOXIC EFFECTS :
- Details of toxic effects not reported other than lethal dose value
- REFERENCE :
- FCTXAV Food and Cosmetics Toxicology. (London, UK) V.1-19, 1963-81. For publisher information, see FCTOD7. Volume(issue)/page/year: 12,819,1974
- TYPE OF TEST :
- LD50 - Lethal dose, 50 percent kill
- ROUTE OF EXPOSURE :
- Administration onto the skin
- SPECIES OBSERVED :
- Rodent - rabbit
- DOSE/DURATION :
- 4700 mg/kg
- TOXIC EFFECTS :
- Details of toxic effects not reported other than lethal dose value
- REFERENCE :
- FCTXAV Food and Cosmetics Toxicology. (London, UK) V.1-19, 1963-81. For publisher information, see FCTOD7. Volume(issue)/page/year: 12,819,1974
Safety Information
[ Risk Phrases ]:
R36/38
[ Safety Phrases ]:
S26-S36/37/39
[ RTECS ]:
GW1960000
[ HS Code ]:
2914299000
Synthetic Route
Customs
[ HS Code ]: 2914299000
[ Summary ]:
2914299000. other cyclanic, cyclenic or cyclotherpenic ketones without other oxygen function. VAT:17.0%. Tax rebate rate:13.0%. . MFN tariff:5.5%. General tariff:30.0%