4a-(hydroxymethyl)-2,4,5,6-tetrahydrobenzo[h]cinnolin-3-one

Modify Date: 2025-09-20 11:41:49

4a-(hydroxymethyl)-2,4,5,6-tetrahydrobenzo[h]cinnolin-3-one structure	Common Name	4a-(hydroxymethyl)-2,4,5,6-tetrahydrobenzo[h]cinnolin-3-one
	CAS Number	126681-63-8	Molecular Weight	230.26200
	Density	1.38g/cm3	Boiling Point	N/A
	Molecular Formula	C₁₃H₁₄N₂O₂	Melting Point	N/A
	MSDS	N/A	Flash Point	N/A

Name	4a-(hydroxymethyl)-2,4,5,6-tetrahydrobenzo[h]cinnolin-3-one
Synonym	More Synonyms

Density	1.38g/cm3
Molecular Formula	C₁₃H₁₄N₂O₂
Molecular Weight	230.26200
Exact Mass	230.10600
PSA	65.18000
LogP	0.54700
Index of Refraction	1.687
InChIKey	MRORQEPNAYBACB-UHFFFAOYSA-N
SMILES	O=C1CC2(CO)CCc3ccccc3C2=NN1

CHEMICAL IDENTIFICATION

RTECS NUMBER :: DE7695000

CHEMICAL NAME :: Benzo(h)cinnolin-3(2H)-one, 4,4a,5,6-tetrahydro-4a-(hydroxymethyl)-

CAS REGISTRY NUMBER :: 126681-63-8

LAST UPDATED :: 199106

DATA ITEMS CITED :: 1

MOLECULAR FORMULA :: C13-H14-N2-O2

MOLECULAR WEIGHT :: 230.29

HEALTH HAZARD DATA

ACUTE TOXICITY DATA

TYPE OF TEST :: LD50 - Lethal dose, 50 percent kill

ROUTE OF EXPOSURE :: Oral

SPECIES OBSERVED :: Rodent - mouse

DOSE/DURATION :: >1 gm/kg

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

REFERENCE :: FRMCE8 Farmaco. (Societa Chimica Italiana, Corso Strada Nova, 86, Casella Postale 227, 27100 Pavia, Italy) V.44- 1989- Volume(issue)/page/year: 44,967,1989

Benzo(h)cinnolin-3(2H)-one,4,4a,5,6-tetrahydro-4a-(hydroxymethyl)

4,4a,5,6-Tetrahydro-4a-(hydroxymethyl)-benzo(h)cinnolin-3(2H)-one

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