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3-Ethynylaniline

Cat#: CCR-0015

3-Ethynylaniline

Empirical Formula (Hill Notation): C8H7N

Size: 5 g

Product Introduction

Molecular Weight 117.15
NACRES NA.22
CAS Number 54060-30-9
MDL Number MFCD00014779
PubChem Substance ID 24873187
Assay ≥98%
Reaction Suitability Reaction type: click chemistry
Smiles String Nc1cccc(c1)C#C
InChI 1S/C8H7N/c1-2-7-4-3-5-8(9)6-7/h1,3-6H,9H2
InChI key NNKQLUVBPJEUOR-UHFFFAOYSA-N
Storage Temp. 2-8 °C

Application

3-Ethynylaniline may be used in the synthesis of the following benzoxazine monomers:bis{4-[3-(3-ethynylphenyl)(2H,4Hbenzo[3,4-e]1,3-oxazin-6-yloxy)]phenyl}phenylphosphino-1-one [3-(3-ethynylphenyl)(2H,4Hbenzo[3,4-e]1,3-oxazaperhydroin-6-yl)][3-(3-ethynylphenyl)(2H,4H-benzo[3,4-e]1,3-oxazin-6-yl)]phenylphosphino-1-one bis[3-(3-ethynylphenyl)(2H,4Hbenzo[3,4-e]1,3-oxazin-6-yl)oxy]phenylphosphino-1-oneIt may be used:To synthesize succin(m-ethynyl)dianilide and sebaco(m-ethynyl)dianilide. As a reagent in the multi-step synthesis of erlotinib hydrochloride. To prepare 3-(3-ethynylphenyl)-6-methyl-2H, 4H-benzo[e]1,3-oxazine.To prepare 3-[3-(4-acetylamino-benzyl)-[1,2,4]oxadiazol-5- yl]-N-(3-ethynyl-phenyl)-propionamide.

Safety Information

Signal Word Warning
Target Organs Respiratory system
Hazard Classifications H226 - H315 - H319 - H335
Storage Class Code 3 - Flammable liquids
WGK WGK 3
Flash Point(F) 138.2 °F - closed cup
Flash Point(C) 59 °C - closed cup

For research use only. Not for clinical use.