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CAS Number: 68981-86-2
4,4-dimethyl-2-(pyridin-3-yl)-4,5-dihydrooxazole

Structure

 4,4-dimethyl-2-(pyridin-3-yl)-4,5-dihydrooxazole
Name: 4,4-dimethyl-2-(pyridin-3-yl)-4,5-dihydrooxazole
Synonyms:
General Information
Product Number: 68981862

CAS Registry Number 68981-86-2
Name:
Pyridine, 3-?(4,?5-?dihydro-?4,?4-?dimethyl-?2-?oxazolyl)?-
3-(4,5-Dihydro-4,4-dimethyl-2-oxazolyl)pyridine
3-(4,4-Dimethyl-2-oxazolinyl)pyridine
3-(4,5-Dihydro-4,4-dimethyloxazol-2-yl)pyridine
4,4-Dimethyl-2-(3-pyridyl)oxazoline

 

Chemical Formula: C10H12N2O
Exact Mass: 176.09
Molecular Weight: 176.22
m/z: 176.09 (100.0%), 177.10 (11.0%)

 

InChI:InChI=1S/C10H12N2O/c1-10(2)7-13-9(12-10)8-4-3-5-11-6-8/h3-6H,7H2,1-2H3

InChI Key:XYABHURTMBEOGW-UHFFFAOYSA-N

Canonical SMILES:CC1(COC(=N1)C2=CN=CC=C2)C

 

Thermal Properties Value Condition Note
Boiling Point 120 °C Press: 0.4 Torr (1)IC
Boiling Point 89-91 °C Press: 0.65 Torr (2)IC
Boiling Point 89 °C Press: 0.5 Torr (3)IC
Boiling Point 88-90 °C Press: 0.8 Torr (4)IC
Melting Point 24 °C   (7)IC

Specification

98%
References
  1. (1) Vorbrueggen, Helmut; Tetrahedron Letters 1981, V22(45), P4471-4 CAPLUS
  2. (2) Hauck, Albert E.; Journal of the Chemical Society, Perkin Transactions 1: Organic and Bio-Organic Chemistry (1972-1999) 1980, (10), P2070-6 CAPLUS
  3. (3) Meyers, A. I.; Journal of Organic Chemistry 1982, V47(13), P2633-7 CAPLUS
  4. (4) Dondoni, Alessandro; Synthesis 1987, (8), P693-6 CAPLUS
  5. (7) Meyers, A. I.; Heterocycles 1978, V11, P133-8 CAPLUS
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