(6aR,9S)-7-methyl-9-(pyrazol-1-ylmethyl)-6,6a,8,9,10,10a-hexahydro-4H-indolo[4,3-fg]quinoline

Modify Date: 2025-11-27 21:15:09

(6aR,9S)-7-methyl-9-(pyrazol-1-ylmethyl)-6,6a,8,9,10,10a-hexahydro-4H-indolo[4,3-fg]quinoline structure	Common Name	(6aR,9S)-7-methyl-9-(pyrazol-1-ylmethyl)-6,6a,8,9,10,10a-hexahydro-4H-indolo[4,3-fg]quinoline
	CAS Number	115178-35-3	Molecular Weight	306.40500
	Density	1.35g/cm3	Boiling Point	518.3ºC at 760mmHg
	Molecular Formula	C₁₉H₂₂N₄	Melting Point	N/A
	MSDS	N/A	Flash Point	267.2ºC

Name	(6aR,9S)-7-methyl-9-(pyrazol-1-ylmethyl)-6,6a,8,9,10,10a-hexahydro-4H-indolo[4,3-fg]quinoline

Density	1.35g/cm3
Boiling Point	518.3ºC at 760mmHg
Molecular Formula	C₁₉H₂₂N₄
Molecular Weight	306.40500
Flash Point	267.2ºC
Exact Mass	306.18400
PSA	36.85000
LogP	2.96250
Vapour Pressure	7.61E-11mmHg at 25°C
Index of Refraction	1.74
InChIKey	CEHQWLQYPXGEQW-HDUJFRAXSA-N
SMILES	CN1CC(Cn2cccn2)CC2c3cccc4[nH]cc(c34)CC21

CHEMICAL IDENTIFICATION

RTECS NUMBER :: KE6344686

CHEMICAL NAME :: Ergoline, 6-methyl-8-(1H-pyrazol-1-ylmethyl)-, (8-alpha)-

CAS REGISTRY NUMBER :: 115178-35-3

LAST UPDATED :: 199603

DATA ITEMS CITED :: 1

MOLECULAR FORMULA :: C19-H22-N4

MOLECULAR WEIGHT :: 306.45

HEALTH HAZARD DATA

ACUTE TOXICITY DATA

TYPE OF TEST :: LDLo - Lowest published lethal dose

ROUTE OF EXPOSURE :: Oral

SPECIES OBSERVED :: Rodent - mouse

DOSE/DURATION :: 200 mg/kg

TOXIC EFFECTS :: Details of toxic effects not reported other than lethal dose value

REFERENCE :: CPBTAL Chemical and Pharmaceutical Bulletin. (Japan Pub. Trading Co., USA, 1255 Howard St., San Francisco, CA 94103) V.6- 1958- Volume(issue)/page/year: 42,2042,1994

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