Propanenitrile, 3,3,3,3-((1,5-dihydroxy-2,6-naphthalenediyl)bis(methylenenitrilo))tetrakis- (9CI)

Modify Date: 2025-10-05 17:06:33

Propanenitrile, 3,3,3,3-((1,5-dihydroxy-2,6-naphthalenediyl)bis(methylenenitrilo))tetrakis- (9CI) structure	Common Name	Propanenitrile, 3,3,3,3-((1,5-dihydroxy-2,6-naphthalenediyl)bis(methylenenitrilo))tetrakis- (9CI)
	CAS Number	73826-31-0	Molecular Weight	430.50200
	Density	1.269g/cm3	Boiling Point	814.1ºC at 760 mmHg
	Molecular Formula	C₂₄H₂₆N₆O₂	Melting Point	N/A
	MSDS	N/A	Flash Point	446.1ºC

Name	3-[[6-[[bis(2-cyanoethyl)amino]methyl]-1,5-dihydroxynaphthalen-2-yl]methyl-(2-cyanoethyl)amino]propanenitrile

Density	1.269g/cm3
Boiling Point	814.1ºC at 760 mmHg
Molecular Formula	C₂₄H₂₆N₆O₂
Molecular Weight	430.50200
Flash Point	446.1ºC
Exact Mass	430.21200
PSA	142.10000
LogP	3.50972
Index of Refraction	1.628
InChIKey	HDRKOCPBVISWHT-UHFFFAOYSA-N
SMILES	N#CCCN(CCC#N)Cc1ccc2c(O)c(CN(CCC#N)CCC#N)ccc2c1O

CHEMICAL IDENTIFICATION

RTECS NUMBER :: UG1565000

CHEMICAL NAME :: Propionitrile, 3,3',3'',3'''-((1,5-dihydroxy-2,6-naphthylene)bis(met hylenenitrilo))tetra-

CAS REGISTRY NUMBER :: 73826-31-0

LAST UPDATED :: 197901

DATA ITEMS CITED :: 1

MOLECULAR FORMULA :: C24-H26-N6-O2

MOLECULAR WEIGHT :: 430.56

WISWESSER LINE NOTATION :: L66J BQ C1N2CN&2CN GQ H1N2CN&2CN

HEALTH HAZARD DATA

ACUTE TOXICITY DATA

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

ROUTE OF EXPOSURE :: Intravenous

SPECIES OBSERVED :: Rodent - mouse

DOSE/DURATION :: 180 mg/kg

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

REFERENCE :: CSLNX* U.S. Army Armament Research & Development Command, Chemical Systems Laboratory, NIOSH Exchange Chemicals. (Aberdeen Proving Ground, MD 21010) Volume(issue)/page/year: NX#03533

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