1,3-Benzodioxole-5-carboxaldehyde,6-nitro-

Modify Date: 2025-09-10 08:19:54

1,3-Benzodioxole-5-carboxaldehyde,6-nitro- structure	Common Name	1,3-Benzodioxole-5-carboxaldehyde,6-nitro-
	CAS Number	712-97-0	Molecular Weight	195.12900
	Density	1.572 g/cm3	Boiling Point	365.9ºC at 760 mmHg
	Molecular Formula	C₈H₅NO₅	Melting Point	93-94 °C(lit.)
	MSDS	Chinese USA	Flash Point	195ºC

Name	6-Nitropiperonal
Synonym	More Synonyms

Density	1.572 g/cm3
Boiling Point	365.9ºC at 760 mmHg
Melting Point	93-94 °C(lit.)
Molecular Formula	C₈H₅NO₅
Molecular Weight	195.12900
Flash Point	195ºC
Exact Mass	195.01700
PSA	81.35000
LogP	1.65920
Index of Refraction	1.658
InChIKey	NRZWECORTTWSEF-UHFFFAOYSA-N
SMILES	O=Cc1cc2c(cc1[N+](=O)[O-])OCO2

MSDS(Chinese)

CHEMICAL IDENTIFICATION

RTECS NUMBER :: DF4912750

CHEMICAL NAME :: 1,3-Benzodioxole-5-carboxaldehyde, 6-nitro-

CAS REGISTRY NUMBER :: 712-97-0

LAST UPDATED :: 199410

DATA ITEMS CITED :: 2

MOLECULAR FORMULA :: C8-H5-N-O5

MOLECULAR WEIGHT :: 195.14

WISWESSER LINE NOTATION :: T56 BO DO CHJ GVH HNW

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 :: 56 mg/kg

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

MUTATION DATA

TYPE OF TEST :: Mutation in microorganisms

TEST SYSTEM :: Bacteria - Salmonella typhimurium

DOSE/DURATION :: 100 ug/plate

REFERENCE :: JAFCAU Journal of Agricultural and Food Chemistry. (American Chemical Soc., Distribution Office Dept. 223, POB 57136, West End Stn., Washington, DC 20037) V.1- 1953- Volume(issue)/page/year: 40,2211,1992

Personal Protective Equipment	Eyeshields;Gloves;type N95 (US);type P1 (EN143) respirator filter
Hazard Codes	Xi
Risk Phrases	R36/37/38
Safety Phrases	S37/39-S26
RIDADR	NONH for all modes of transport
WGK Germany	3
RTECS	DF4912750
HS Code	2932999099

HS Code	2932999099
Summary	2932999099. other heterocyclic compounds with oxygen hetero-atom(s) only. VAT:17.0%. Tax rebate rate:13.0%. . MFN tariff:6.5%. General tariff:20.0%

No-carrier-added regioselective preparation of 6-[18F]fluoro-L-dopa.

J. Nucl. Med. 31(7) , 1247-51, (1990)

This paper describes the preparation of 6-[18F]fluoro-L-dopa by a no-carrier-added method based on the nucleophilic displacement of nitro groups of two commercially available substrates, 3,4-dimethoxy...

Can we predict reactivity for aromatic nucleophilic substitution with [18F] fluoride ion? Rengan R, et al.

J. Labelled Comp. Radiopharm. 33(7) , 563-572, (1993)

MFCD00005829

EINECS 211-926-1

6-nitro-1,3-benzodioxole-5-carbaldehyde