2,5-Di(1-naphthyl)-1,3,4-oxadiazole

Catalog Number

ACM905624-1

CAS

905-62-4

IUPAC Name

2,5-dinaphthalen-1-yl-1,3,4-oxadiazole

Molecular Weight

322.37

Molecular Formula

C22H14N2O

Product Information

Canonical SMILES

C1=CC=C2C(=C1)C=CC=C2C3=NN=C(O3)C4=CC=CC5=CC=CC=C54

Inchi

InChI=1S/C11H26N.C2F6NO4S2/c1-5-9-10-11-12(6-2,7-3)8-4;3-1(4,5)14(10,11)9-15(12,13)2(6,7)8/h5-11H2,1-4H3;/q+1;-1

InChIKey

ALYCOCULEAWWJO-UHFFFAOYSA-N

Melting Point

179 °C

Purity

>98.0%(HPLC)(N)

Appearance

White to Amber to Dark green powder to crystal

storage

Store under inert gas

Complexity

415

Condition To Avoid

Air Sensitive

Hazard Statements

H315 : Causes skin irritation.H319 : Causes serious eye irritation.

Heavy Atom Count

MDL Number

MFCD00045582

Precautionary Statements

P264 : Wash skin thoroughly after handling.P280 : Wear protective gloves/ eye protection/ face protection.P337 + P313 : If eye irritation persists: Get medical advice/ attention.P305 + P351 + P338 : IF IN EYES: Rinse cautiously with water for several minutes. Remove contact lenses, if present and easy to do. Continue rinsing.P302 + P352 : IF ON SKIN: Wash with plenty of soap and water.P332 + P313 : If skin irritation occurs: Get medical advice/ attention.P362 : Take off contaminated clothing and wash before reuse.

Reaxys Registry Number

285250

Rotatable Bond Count

Signal Word

Warning

Monoisotopic Mass

322.110613g/mol

Exact Mass

322.110613g/mol