Cas no 515815-38-0 (Benzenepropanoic acid, 4-hydroxy-3,5-bis(1-methylethyl)-)
515815-38-0 structure
Product Name:Benzenepropanoic acid, 4-hydroxy-3,5-bis(1-methylethyl)-
CAS No:515815-38-0
MF:C15H22O3
MW:250.333384990692
CID:1571813
Update Time:2024-08-24
Benzenepropanoic acid, 4-hydroxy-3,5-bis(1-methylethyl)- Chemical and Physical Properties
Names and Identifiers
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- Benzenepropanoic acid, 4-hydroxy-3,5-bis(1-methylethyl)-
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- Inchi： 1S/C15H22O3/c1-9(2)12-7-11(5-6-14(16)17)8-13(10(3)4)15(12)18/h7-10,18H,5-6H2,1-4H3,(H,16,17)
- InChI Key： SHZKJFVJRYMJGN-UHFFFAOYSA-N
- SMILES： C1(CCC(O)=O)=CC(C(C)C)=C(O)C(C(C)C)=C1
Computed Properties
- Exact Mass: 250.15696
Experimental Properties
- Density: 1.079±0.06 g/cm3(Predicted)
- Boiling Point: 377.3±37.0 °C(Predicted)
- PSA: 57.53
- pka: 4.78±0.10(Predicted)
Benzenepropanoic acid, 4-hydroxy-3,5-bis(1-methylethyl)- Related Literature
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Bo Wei,Zhenyu Liu,Chen Xie,Shu Yang,Wentao Tang,Aiwei Gu,Wing-Tak Wong,Ka-Leung Wong J. Mater. Chem. C, 2015,3, 12322-12327
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Xinhuan Wang,Shuangfei Cai,Cui Qi Analyst, 2017,142, 2500-2506
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Alexandre Vimont,Arnaud Travert,Philippe Bazin,Jean-Claude Lavalley,Marco Daturi,Christian Serre,Gérard Férey,Sandrine Bourrelly,Philip L. Llewellyn Chem. Commun., 2007, 3291-3293
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J. Matthew Kurley,Phillip W. Halstenberg,Abbey McAlister,Stephen Raiman,Richard T. Mayes RSC Adv., 2019,9, 25602-25608
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Vishwesh Venkatraman,Marco Foscato,Vidar R. Jensen,Bj?rn K?re Alsberg J. Mater. Chem. A, 2015,3, 9851-9860
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