2-nitrosooxazinane

Modify Date: 2024-03-02 09:44:34

2-nitrosooxazinane Structure
2-nitrosooxazinane structure
Common Name 2-nitrosooxazinane
CAS Number 40548-68-3 Molecular Weight 116.11900
Density 1.32g/cm3 Boiling Point 127.3ºC at 760 mmHg
Molecular Formula C4H8N2O2 Melting Point N/A
MSDS N/A Flash Point 30.8ºC

 Names

Name 2-nitrosooxazinane
Synonym More Synonyms

 Chemical & Physical Properties

Density 1.32g/cm3
Boiling Point 127.3ºC at 760 mmHg
Molecular Formula C4H8N2O2
Molecular Weight 116.11900
Flash Point 30.8ºC
Exact Mass 116.05900
PSA 41.90000
LogP 0.63310
Index of Refraction 1.546
InChIKey PREXGTBZMLDXHV-UHFFFAOYSA-N
SMILES O=NN1CCCCO1

 Toxicological Information

CHEMICAL IDENTIFICATION

RTECS NUMBER :
RP6430000
CHEMICAL NAME :
2H-1,2-Oxazine, tetrahydro-2-nitroso-
CAS REGISTRY NUMBER :
40548-68-3
BEILSTEIN REFERENCE NO. :
0112124
LAST UPDATED :
199612
DATA ITEMS CITED :
2
MOLECULAR FORMULA :
C4-H8-N2-O2
MOLECULAR WEIGHT :
116.14
WISWESSER LINE NOTATION :
T6NOTJ ANO

HEALTH HAZARD DATA

ACUTE TOXICITY DATA

TYPE OF TEST :
LD50 - Lethal dose, 50 percent kill
ROUTE OF EXPOSURE :
Oral
SPECIES OBSERVED :
Rodent - rat
DOSE/DURATION :
830 mg/kg
TOXIC EFFECTS :
Brain and Coverings - changes in circulation (hemorrhage, thrombosis, etc.) Liver - hepatitis (hepatocellular necrosis), zonal Blood - hemorrhage
REFERENCE :
ZKKOBW Zeitschrift fuer Krebsforschung und Klinische Onkologie. (Berlin, Fed. Rep. Ger.) V.76-92, 1971-78. For publisher information, see JCROD7. Volume(issue)/page/year: 79,114,1973 ** TUMORIGENIC DATA **
TYPE OF TEST :
TDLo - Lowest published toxic dose
ROUTE OF EXPOSURE :
Oral
SPECIES OBSERVED :
Rodent - rat
DOSE/DURATION :
18 gm/kg/63W-I
TOXIC EFFECTS :
Tumorigenic - Carcinogenic by RTECS criteria Lungs, Thorax, or Respiration - tumors Skin and Appendages - tumors
REFERENCE :
ZKKOBW Zeitschrift fuer Krebsforschung und Klinische Onkologie. (Berlin, Fed. Rep. Ger.) V.76-92, 1971-78. For publisher information, see JCROD7. Volume(issue)/page/year: 79,114,1973

 Safety Information

HS Code 2934999090

 Synthetic Route

~64%

2-nitrosooxazinane Structure

2-nitrosooxazinane

CAS#:40548-68-3

Literature: Bhat, J. Ishwara; Clegg, William; Maskill, Howard; Elsegood, Mark R.J.; Menneer, Iain D.; Miatt, Peter C. Journal of the Chemical Society. Perkin Transactions 2, 2000 , # 7 p. 1435 - 1446

~%

2-nitrosooxazinane Structure

2-nitrosooxazinane

CAS#:40548-68-3

Literature: Wichterle; Novak Collection of Czechoslovak Chemical Communications, 1950 , vol. 15, p. 309,313

 Customs

HS Code 2934999090
Summary 2934999090. other heterocyclic compounds. VAT:17.0%. Tax rebate rate:13.0%. . MFN tariff:6.5%. General tariff:20.0%

 Synonyms

2H-1,2-Oxazine,2-nitrosotetrahydro
N-nitrosotetrahydro-1,2-oxazine
2-Nitrosotetrahydro-1,2-oxazine
N-Nitrosotetrahydro-1,2-oxazin
2H-1,2-Oxazine,tetrahydro-2-nitroso
Tetrahydro-2-nitroso-2H-1,2-oxazine
2-nitroso-1,2-oxazinane
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