Cas no 168400-03-1 (Phenol,4-[(1S,2S,5R)-5-ethenyl-5-methyl-2-(1-methylethenyl)cyclohexyl]-)
168400-03-1 structure
Product Name:Phenol,4-[(1S,2S,5R)-5-ethenyl-5-methyl-2-(1-methylethenyl)cyclohexyl]-
CAS No:168400-03-1
MF:C18H24O
MW:256.382565498352
CID:228703
Update Time:2024-03-01
Phenol,4-[(1S,2S,5R)-5-ethenyl-5-methyl-2-(1-methylethenyl)cyclohexyl]- Chemical and Physical Properties
Names and Identifiers
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- Phenol,4-[(1S,2S,5R)-5-ethenyl-5-methyl-2-(1-methylethenyl)cyclohexyl]-
- Cyclobakuchiol A
- Phenol,4-[5-ethenyl-5-methyl-2-(1-methylethenyl)cyclohexyl]-, [1S-(1a,2b,5b)]-
- Phenol, 4-[(1S,2S,5R)-5-ethenyl-5-methyl-2-(1-methylethenyl)cyclohexyl]-
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- Inchi: 1S/C18H24O/c1-5-18(4)11-10-16(13(2)3)17(12-18)14-6-8-15(19)9-7-14/h5-9,16-17,19H,1-2,10-12H2,3-4H3/t16-,17-,18-/m1/s1
- InChI Key: DUTYKARAVUNUBK-KZNAEPCWSA-N
- SMILES: C1(O)=CC=C([C@H]2C[C@@](C=C)(C)CC[C@@H]2C(C)=C)C=C1
Computed Properties
- Exact Mass: 256.18282
Experimental Properties
- Density: 1.009±0.06 g/cm3(Predicted)
- Boiling Point: 363.3±42.0 °C(Predicted)
- PSA: 20.23
- pka: 10.21±0.30(Predicted)
Phenol,4-[(1S,2S,5R)-5-ethenyl-5-methyl-2-(1-methylethenyl)cyclohexyl]- Related Literature
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Xing Zhao,Lu Bai,Rui-Ying Bao,Zheng-Ying Liu,Ming-Bo Yang,Wei Yang RSC Adv., 2017,7, 46297-46305
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Abdelaziz Houmam,Emad M. Hamed Chem. Commun., 2012,48, 11328-11330
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Ross Harder,David C. Dunand,Ian McNulty Nanoscale, 2017,9, 5686-5693
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Fereshteh Bayat Environ. Sci.: Nano, 2021,8, 367-389
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