Cas no 952491-03-1 (2(1H)-Azulenone, 4,5,6,7,8,8a-hexahydro-5-[1-(hydroxymethyl)ethenyl]-3,8-dimethyl-, (5R,8S,8aS)-)
952491-03-1 structure
Product Name:2(1H)-Azulenone, 4,5,6,7,8,8a-hexahydro-5-[1-(hydroxymethyl)ethenyl]-3,8-dimethyl-, (5R,8S,8aS)-
CAS No:952491-03-1
MF:C15H22O2
MW:234.333984851837
CID:6641136
Update Time:2024-01-29
2(1H)-Azulenone, 4,5,6,7,8,8a-hexahydro-5-[1-(hydroxymethyl)ethenyl]-3,8-dimethyl-, (5R,8S,8aS)- Chemical and Physical Properties
Names and Identifiers
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- 2(1H)-Azulenone, 4,5,6,7,8,8a-hexahydro-5-[1-(hydroxymethyl)ethenyl]-3,8-dimethyl-, (5R,8S,8aS)-
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- Inchi: 1S/C15H22O2/c1-9-4-5-12(10(2)8-16)6-14-11(3)15(17)7-13(9)14/h9,12-13,16H,2,4-8H2,1,3H3/t9-,12+,13-/m0/s1
- InChI Key: MNHVBENJUMXBJB-BIMULSAOSA-N
- SMILES: C1[C@]2([H])C(C[C@H](C(CO)=C)CC[C@@H]2C)=C(C)C1=O
Experimental Properties
- Density: 1.05±0.1 g/cm3(Predicted)
- Boiling Point: 384.1±21.0 °C(Predicted)
- pka: 14.75±0.10(Predicted)
2(1H)-Azulenone, 4,5,6,7,8,8a-hexahydro-5-[1-(hydroxymethyl)ethenyl]-3,8-dimethyl-, (5R,8S,8aS)- Related Literature
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Alvin Tanudjaja,Shinsuke Inagi,Fusao Kitamura,Toshikazu Takata,Ikuyoshi Tomita Dalton Trans., 2021,50, 3037-3043
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P. K. Wawrzyniak,M. T. P. Beerepoot,H. J. M. de Groot,F. Buda Phys. Chem. Chem. Phys., 2011,13, 10270-10279
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Luis Miguel Azofra,Douglas R. MacFarlane,Chenghua Sun Chem. Commun., 2016,52, 3548-3551
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Yang Xu,Min Wang,Donghui Wei,Rongqiang Tian,Zheng Duan,Fran?ois Mathey Dalton Trans., 2019,48, 5523-5526
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J. M. Granadino-Roldán,M. Fernández-Gómez,A. Navarro,T. Pe?a Ruiz,U. A. Jayasooriya Phys. Chem. Chem. Phys., 2004,6, 1133-1143
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