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CAS Number: 54060-30-9
3-ethynylaniline

Structure

3-ethynylaniline
Name: 3-ethynylaniline
Synonyms:
General Information
Product Number: 54060309

CAS Registry Number 54060-30-9
Name:
Benzenamine, 3-?ethynyl-
3-Ethynylbenzenamine
(3-Aminophenyl)acetylene
(3-Ethynylphenyl)amine
(m-Aminophenyl)acetylene
1-Amino-3-ethynylbenzene

 

Chemical Formula: C8H7N
Exact Mass: 117.06
Molecular Weight: 117.15
m/z: 117.06 (100.0%), 118.06 (8.7%)

 

InChI:InChI=1S/C8H7N/c1-2-7-4-3-5-8(9)6-7/h1,3-6H,9H2

InChI Key:NNKQLUVBPJEUOR-UHFFFAOYSA-N

Canonical SMILES:C#CC1=CC(=CC=C1)N

Specification

98%

References
  1. (1) Onopchenko, Anatoli; Journal of Organic Chemistry 1979, V44(21), P3671-4 CAPLUS
  2. (8) Onopchenko, Anatoli; Journal of Organic Chemistry 1979, V44(8), P1233-6 CAPLUS
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