Cas no 139694-94-3 (5-Azulenemethanol, 1,2,3,3a,4,5,6,7-octahydro-)
139694-94-3 structure
Product Name:5-Azulenemethanol, 1,2,3,3a,4,5,6,7-octahydro-
CAS No:139694-94-3
MF:C11H18O
MW:166.260023593903
CID:1279561
Update Time:2024-08-03
5-Azulenemethanol, 1,2,3,3a,4,5,6,7-octahydro- Chemical and Physical Properties
Names and Identifiers
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- 5-Azulenemethanol, 1,2,3,3a,4,5,6,7-octahydro-
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- Inchi： 1S/C11H18O/c12-8-9-3-1-4-10-5-2-6-11(10)7-9/h4,9,11-12H,1-3,5-8H2
- InChI Key： LQKYFPPRCPAXFR-UHFFFAOYSA-N
- SMILES： C1C2C(CC(CO)CCC=2)CC1
Computed Properties
- Exact Mass: 166.13584
Experimental Properties
- Density: 1.00±0.1 g/cm3(Predicted)
- Boiling Point: 277.3±9.0 °C(Predicted)
- PSA: 20.23
- pka: 14.96±0.10(Predicted)
5-Azulenemethanol, 1,2,3,3a,4,5,6,7-octahydro- Related Literature
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Teresita Carrillo-Hernández,Philippe Schaeffer,Pierre Albrecht Chem. Commun., 2001, 1976-1977
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Kanjun Sun,Fengting Hua,Shuzhen Cui,Yanrong Zhu,Hui Peng,Guofu Ma RSC Adv., 2021,11, 37631-37642
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M. T. Colomer,S. Díaz-Moreno,A. Tamayo,A. L. Ortiz J. Mater. Chem. C, 2018,6, 12643-12651
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