2-(3,4,5,6-tetrahydro-2H-pyridin-1-yl)-1-[7-[2-(3,4,5,6-tetrahydro-2H-pyridin-1-yl)acetyl]-9H-xanthen-2-yl]ethanone dichloride

Modify Date: 2025-09-18 16:59:28

2-(3,4,5,6-tetrahydro-2H-pyridin-1-yl)-1-[7-[2-(3,4,5,6-tetrahydro-2H-pyridin-1-yl)acetyl]-9H-xanthen-2-yl]ethanone dichloride structure	Common Name	2-(3,4,5,6-tetrahydro-2H-pyridin-1-yl)-1-[7-[2-(3,4,5,6-tetrahydro-2H-pyridin-1-yl)acetyl]-9H-xanthen-2-yl]ethanone dichloride
	CAS Number	37971-96-3	Molecular Weight	469.01600
	Density	1.177g/cm3	Boiling Point	616.7ºC at 760 mmHg
	Molecular Formula	C₂₇H₃₃ClN₂O₃	Melting Point	N/A
	MSDS	N/A	Flash Point	326.8ºC

Name	2-piperidin-1-yl-1-[7-(2-piperidin-1-ylacetyl)-9H-xanthen-2-yl]ethanone

Density	1.177g/cm3
Boiling Point	616.7ºC at 760 mmHg
Molecular Formula	C₂₇H₃₃ClN₂O₃
Molecular Weight	469.01600
Flash Point	326.8ºC
Exact Mass	468.21800
PSA	49.85000
LogP	5.39810
Index of Refraction	1.594
InChIKey	LQLRKABTMZKMIR-UHFFFAOYSA-N
SMILES	O=C(CN1CCCCC1)c1ccc2c(c1)Cc1cc(C(=O)CN3CCCCC3)ccc1O2

CHEMICAL IDENTIFICATION

RTECS NUMBER :: KM5800000

CAS REGISTRY NUMBER :: 37971-96-3

LAST UPDATED :: 199303

DATA ITEMS CITED :: 1

MOLECULAR FORMULA :: C27-H32-N2-O3.2Cl-H.7/2H2-O

MOLECULAR WEIGHT :: 568.53

WISWESSER LINE NOTATION :: T C666 BO IHJ FV1- AT6NTJ& LV1- AT6NTJ &GH 2 &QH 7/2

HEALTH HAZARD DATA

ACUTE TOXICITY DATA

TYPE OF TEST :: LDLo - Lowest published lethal dose

ROUTE OF EXPOSURE :: Subcutaneous

SPECIES OBSERVED :: Rodent - mouse

DOSE/DURATION :: 250 mg/kg

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

REFERENCE :: JMCMAR Journal of Medicinal Chemistry. (American Chemical Soc., Distribution Office Dept. 223, POB POB 57136, West End Stn., Washington, DC 20037) V.6- 1963- Volume(issue)/page/year: 19,1142,1976

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