3-tert-butyl-1-oxa-2-aza-3-azoniacyclopenta-2,4-dien-5-olate

Modify Date: 2024-01-08 09:25:44

3-tert-butyl-1-oxa-2-aza-3-azoniacyclopenta-2,4-dien-5-olate structure	Common Name	3-tert-butyl-1-oxa-2-aza-3-azoniacyclopenta-2,4-dien-5-olate
	CAS Number	6939-25-9	Molecular Weight	142.15600
	Density	N/A	Boiling Point	N/A
	Molecular Formula	C₆H₁₀N₂O₂	Melting Point	N/A
	MSDS	N/A	Flash Point	N/A

Name	3-tert-butyloxadiazol-3-ium-5-olate
Synonym	More Synonyms

Molecular Formula	C₆H₁₀N₂O₂
Molecular Weight	142.15600
Exact Mass	142.07400
PSA	52.97000
LogP	0.86090
InChIKey	YPJWMANOXFBBFC-UHFFFAOYSA-N
SMILES	CC(C)(C)[n+]1cc([O-])on1

CHEMICAL IDENTIFICATION

RTECS NUMBER :: WU7675350

CHEMICAL NAME :: Sydnone, 3-tert-butyl-

CAS REGISTRY NUMBER :: 6939-25-9

LAST UPDATED :: 199612

DATA ITEMS CITED :: 1

MOLECULAR FORMULA :: C6-H10-N2-O2

MOLECULAR WEIGHT :: 142.18

WISWESSER LINE NOTATION :: T5NNOVJ AX1&1&1

HEALTH HAZARD DATA

ACUTE TOXICITY DATA

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

ROUTE OF EXPOSURE :: Intraperitoneal

SPECIES OBSERVED :: Rodent - mouse

DOSE/DURATION :: 187 mg/kg

TOXIC EFFECTS :: Behavioral - convulsions or effect on seizure threshold

REFERENCE :: JPMSAE Journal of Pharmaceutical Sciences. (American Pharmaceutical Assoc., 2215 Constitution Ave., NW, Washington, DC 20037) V.50- 1961- Volume(issue)/page/year: 51,1058,1962

Aceticacid, 2-[(1,1-dimethylethyl)nitrosoamino]- structure

Aceticacid, 2-[...

CAS#:6939-24-8

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3-tert-butyl-1-oxa-2-aza-3-azoniacyclopenta-2,4-dien-5-olate Structure

3-tert-butyl-1-...

CAS#:6939-25-9

Literature: Prochazka,M. et al. Collection of Czechoslovak Chemical Communications, 1971 , vol. 36, p. 2640 - 2647

ethyl 2-(tert-butylamino)acetate structure

ethyl 2-(tert-b...

CAS#:37885-76-0

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3-tert-butyl-1-oxa-2-aza-3-azoniacyclopenta-2,4-dien-5-olate Structure

3-tert-butyl-1-...

CAS#:6939-25-9

Literature: Gribble, Gordon W.; Hirth, Bradford H. Journal of Heterocyclic Chemistry, 1996 , vol. 33, # 3 p. 719 - 726

n-t-butylglycine sodium salt structure

n-t-butylglycin...

CAS#:58482-93-2

~%

3-tert-butyl-1-oxa-2-aza-3-azoniacyclopenta-2,4-dien-5-olate Structure

3-tert-butyl-1-...

CAS#:6939-25-9

Literature: Gribble, Gordon W.; Hirth, Bradford H. Journal of Heterocyclic Chemistry, 1996 , vol. 33, # 3 p. 719 - 726

Precursor 3
CAS#:6939-24-8 Aceticacid, 2-[... CAS#:37885-76-0 ethyl 2-(tert-b... CAS#:58482-93-2 n-t-butylglycin...
DownStream 4
CAS#:32064-67-8 tert-butylhydrazine CAS#:682757-45-5 1H-Pyrazole-4-c... CAS#:682757-46-6 1H-Pyrazole-3-c... CAS#:682757-49-9 ethyl 1-tert-bu...

3-tert.-Butyl-sydnon

N-tert.Butylsydnon

Sydnone,3-tert-butyl

3-tert-Butylsydnone

N-tert-Butylsydnone

Sydnone,1-dimethylethyl)

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