121625-71-6

121625-71-6 structure

121625-71-6 structure

Name: 2-(1-butyl-2,6,6-trimethyl-4-oxo-5,7-dihydroindol-3-yl)acetic acid
Chemical Name: 2-(1-butyl-2,6,6-trimethyl-4-oxo-5,7-dihydroindol-3-yl)acetic acid
CAS Number: 121625-71-6
Molecular Formula: C₁₇H₂₅NO₃
Molecular Weight: 291.38500
Create Date: 2016-05-21 04:59:02
Modify Date: 2024-02-02 15:19:27

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

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

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