2-(1-butyl-2,6,6-trimethyl-4-oxo-5,7-dihydroindol-3-yl)acetic acid
Names
[ CAS No. ]:
121625-71-6
[ Name ]:
2-(1-butyl-2,6,6-trimethyl-4-oxo-5,7-dihydroindol-3-yl)acetic acid
[Synonym ]:
1H-Indole-3-acetic acid,4,5,6,7-tetrahydro-1-butyl-4-oxo-2,6,6-trimethyl
1-n-butyl-2,6,6'-trimethyl-4-oxo-4,5,6,7-tetrahydro-3-indole acetic acid
1H-Indole-3-aceticacid,1-butyl-4,5,6,7-tetrahydro-2,6,6-trimethyl-4-oxo
4,5,6,7-Tetrahydro-1-butyl-4-oxo-2,6,6-trimethyl-indole-3-acetic acid
1-n-butyl-2,6,6-trimethyl-4-oxo-4,5,6,7-tetrahydroindole-3-acetic acid
C 8778-GO
Chemical & Physical Properties
[ Density]:
1.14g/cm3
[ Boiling Point ]:
477ºC at 760mmHg
[ Molecular Formula ]:
C17H25NO3
[ Molecular Weight ]:
291.38500
[ Flash Point ]:
242.3ºC
[ Exact Mass ]:
291.18300
[ PSA ]:
59.30000
[ LogP ]:
3.37880
[ Vapour Pressure ]:
6.62E-10mmHg at 25°C
[ Index of Refraction ]:
1.56
Toxicological Information
CHEMICAL IDENTIFICATION
- RTECS NUMBER :
- NL3667900
- CHEMICAL NAME :
- 1H-Indole-3-acetic acid, 4,5,6,7-tetrahydro-1-butyl-4-oxo-2,6,6-trimethyl-
- CAS REGISTRY NUMBER :
- 121625-71-6
- LAST UPDATED :
- 199612
- DATA ITEMS CITED :
- 3
- MOLECULAR FORMULA :
- C17-H25-N-O3
- MOLECULAR WEIGHT :
- 291.43
HEALTH HAZARD DATA
ACUTE TOXICITY DATA
- TYPE OF TEST :
- LD50 - Lethal dose, 50 percent kill
- ROUTE OF EXPOSURE :
- Oral
- SPECIES OBSERVED :
- Rodent - rat
- DOSE/DURATION :
- >3 gm/kg
- TOXIC EFFECTS :
- Details of toxic effects not reported other than lethal dose value
- REFERENCE :
- ARZNAD Arzneimittel-Forschung. Drug Research. (Editio Cantor Verlag, Postfach 1255, W-7960 Aulendorf, Fed. Rep. Ger.) V.1- 1951- Volume(issue)/page/year: 39,548,1989
- TYPE OF TEST :
- LD50 - Lethal dose, 50 percent kill
- ROUTE OF EXPOSURE :
- Oral
- SPECIES OBSERVED :
- Rodent - mouse
- DOSE/DURATION :
- 2667 mg/kg
- TOXIC EFFECTS :
- Details of toxic effects not reported other than lethal dose value
- REFERENCE :
- ARZNAD Arzneimittel-Forschung. Drug Research. (Editio Cantor Verlag, Postfach 1255, W-7960 Aulendorf, Fed. Rep. Ger.) V.1- 1951- Volume(issue)/page/year: 39,548,1989
- TYPE OF TEST :
- LD50 - Lethal dose, 50 percent kill
- ROUTE OF EXPOSURE :
- Oral
- SPECIES OBSERVED :
- Mammal - dog
- DOSE/DURATION :
- >500 mg/kg
- TOXIC EFFECTS :
- Details of toxic effects not reported other than lethal dose value
- REFERENCE :
- ARZNAD Arzneimittel-Forschung. Drug Research. (Editio Cantor Verlag, Postfach 1255, W-7960 Aulendorf, Fed. Rep. Ger.) V.1- 1951- Volume(issue)/page/year: 39,548,1989