2-(1-butyl-2,6,6-trimethyl-4-oxo-5,7-dihydroindol-3-yl)acetic acid

Names

[ 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

Related Compounds

4-methyl-5-[(methylamino)acetyl]-1,3,4,5-tetrahydro-2H-1,5-benzodiazepin-2-one
(2E)-3-[4-(difluoromethoxy)-5-methoxy-2-nitrophenyl]acrylic acid
(1Z)-3-chloro-1-(1,3,3-trimethyl-1,3-dihydro-2H-indol-2-ylidene)butan-2-one
4-(5-formyl-2-furyl)-N-phenylbenzenesulfonamide
1H-benzimidazol-2-yl(methylsulfonyl)acetaldehyde
2-[(cyclopropylcarbonyl)amino]-3-(1H-indol-3-yl)propanoic acid
2-chloro-N-6,7-dihydro[1,4]dioxino[2,3-f][1,3]benzothiazol-2-ylacetamide
5-(Aminomethyl)-N,N-diethylthiophene-2-sulfonamide
[5-(Morpholine-4-sulfonyl)thiophen-2-yl]methanamine
N,N,1-trimethyl-3-oxo-1,2,3,4-tetrahydroquinoxaline-6-sulfonamide

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