Cas no 105701-29-9 (Benzoic acid, 4-[4-(2-methylbutoxy)butoxy]-)
![Benzoic acid, 4-[4-(2-methylbutoxy)butoxy]- structure](https://ossimg.kuujia.com/scimg/106000/105701-29-9x500.png)
105701-29-9 structure
Product Name:Benzoic acid, 4-[4-(2-methylbutoxy)butoxy]-
CAS No:105701-29-9
MF:C16H24O4
MW:280.359365463257
CID:1161796
Update Time:2024-07-26
Benzoic acid, 4-[4-(2-methylbutoxy)butoxy]- Chemical and Physical Properties
Names and Identifiers
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- Benzoic acid, 4-[4-(2-methylbutoxy)butoxy]-
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- Inchi： 1S/C16H24O4/c1-3-13(2)12-19-10-4-5-11-20-15-8-6-14(7-9-15)16(17)18/h6-9,13H,3-5,10-12H2,1-2H3,(H,17,18)
- InChI Key： RMTCSERJIUILGV-UHFFFAOYSA-N
- SMILES： C(O)(=O)C1=CC=C(OCCCCOCC(C)CC)C=C1
Computed Properties
- Exact Mass: 468.32412
Experimental Properties
- Density: 1.058±0.06 g/cm3(Predicted)
- Boiling Point: 413.6±25.0 °C(Predicted)
- PSA: 44.76
- pka: 4.47±0.10(Predicted)
Benzoic acid, 4-[4-(2-methylbutoxy)butoxy]- Related Literature
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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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Alvin Tanudjaja,Shinsuke Inagi,Fusao Kitamura,Toshikazu Takata,Ikuyoshi Tomita Dalton Trans., 2021,50, 3037-3043
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Supaporn Sawadjoon,Joseph S. M. Samec Org. Biomol. Chem., 2011,9, 2548-2554
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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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Stephen P. Fletcher,Richard B. C. Jagt,Ben L. Feringa Chem. Commun., 2007, 2578-2580
105701-29-9 (Benzoic acid, 4-[4-(2-methylbutoxy)butoxy]-) Related Products
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