CAS 1612-76-6|5-Phenyl-1,3,4-oxadiazol-2-amine

Introduction:Basic information about CAS 1612-76-6|5-Phenyl-1,3,4-oxadiazol-2-amine, including its chemical name, molecular formula, synonyms, physicochemical properties, and safety information, etc.
Common Name5-Phenyl-1,3,4-oxadiazol-2-amine
CAS Number1612-76-6Molecular Weight161.161
Density1.3±0.1 g/cm3Boiling Point332.3±25.0 °C at 760 mmHg
Molecular FormulaC8H7N3OMelting Point237-242°C
MSDS/Flash Point154.7±23.2 °C

Names

Name5-Phenyl-1,3,4-oxadiazol-2-amine
SynonymMore Synonyms

Chemical & Physical Properties

Density1.3±0.1 g/cm3
Boiling Point332.3±25.0 °C at 760 mmHg
Melting Point237-242°C
Molecular FormulaC8H7N3O
Molecular Weight161.161
Flash Point154.7±23.2 °C
Exact Mass161.058914
PSA64.94000
LogP1.45
Vapour Pressure0.0±0.7 mmHg at 25°C
Index of Refraction1.606
InChIKeyCQSFYCBGVMWPCM-UHFFFAOYSA-N
SMILESNc1nnc(-c2ccccc2)o1
Storage condition2-8°C

Toxicological Information

CHEMICAL IDENTIFICATION

RTECS NUMBER :
RO0620000
CHEMICAL NAME :
1,3,4-Oxadiazole, 2-amino-5-phenyl-
CAS REGISTRY NUMBER :
1612-76-6
LAST UPDATED :
199009
DATA ITEMS CITED :
2
MOLECULAR FORMULA :
C8-H7-N3-O
MOLECULAR WEIGHT :
161.18
WISWESSER LINE NOTATION :
T5NN DOJ CZ ER

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 :
300 mg/kg
TOXIC EFFECTS :
Details of toxic effects not reported other than lethal dose value
REFERENCE :
JMCMAR Journal of Medicinal Chemistry. (American Chemical Soc., Distribution Office Dept. 223, POB POB 57136, West End Stn., Washington, DC 20037) V.6- 1963- Volume(issue)/page/year: 9,478,1966
TYPE OF TEST :
LD50 - Lethal dose, 50 percent kill
ROUTE OF EXPOSURE :
Intraperitoneal
SPECIES OBSERVED :
Rodent - mouse
DOSE/DURATION :
219 mg/kg
TOXIC EFFECTS :
Peripheral Nerve and Sensation - flaccid paralysis without anesthesia (usually neuromuscular blockage) Behavioral - changes in motor activity (specific assay) Behavioral - muscle weakness
REFERENCE :
FRPSAX Farmaco, Edizione Scientifica. (Casella Postale 227, 27100 Pavia, Italy) V.8-43 1953-88 For publisher information, see FRMCE8 Volume(issue)/page/year: 13,629,1958

Safety Information

Hazard CodesXn
Risk Phrases22-36/37/38
Safety Phrases26-36
HS Code2934999090

Customs

HS Code2934999090
Summary2934999090. other heterocyclic compounds. VAT:17.0%. Tax rebate rate:13.0%. . MFN tariff:6.5%. General tariff:20.0%

Synonyms

1,3,4-Oxadiazol-2-amine, 5-phenyl-
5-Phenyl-1,3,4-oxadiazol-2-amine
MFCD00126383
5-Phenyl-[1,3,4]oxadiazol-2-ylamine
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