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13243-39-5

13243-39-5 Structure

13243-39-5 Structure
IdentificationBack Directory
[Name]

2-Ethyl-6-nitrobenzoxazole
[CAS]

13243-39-5
[Synonyms]

2-Ethyl-6-nitrobenzoxazole
Benzoxazole, 2-ethyl-6-nitro-
2-Ethyl-6-nitrobenzo[d]oxazole
[Molecular Formula]

C9H8N2O3
[MDL Number]

MFCD03791183
[MOL File]

13243-39-5.mol
[Molecular Weight]

192.17
Chemical PropertiesBack Directory
[Melting point ]

85-86 °C
[Boiling point ]

312.4±15.0 °C(Predicted)
[density ]

1.332±0.06 g/cm3(Predicted)
[storage temp. ]

2-8°C
[form ]

solid
[pka]

-1.50±0.30(Predicted)
[InChI]

1S/C9H8N2O3/c1-2-9-10-7-4-3-6(11(12)13)5-8(7)14-9/h3-5H,2H2,1H3
[InChIKey]

PCGXXJTVFLMTPJ-UHFFFAOYSA-N
[SMILES]

CCC(O1)=NC(C1=C2)=CC=C2[N+]([O-])=O
Safety DataBack Directory
[WGK Germany ]

WGK 3
[HS Code ]

2934999090
[Storage Class]

6.1C - Combustible acute toxic Cat.3
toxic compounds or compounds which causing chronic effects
[Hazard Classifications]

Acute Tox. 3 Oral
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