Cas no 153545-91-6 (Propanoic acid, 2-(4-ethylphenoxy)-, (2R)-)
153545-91-6 structure
Product Name:Propanoic acid, 2-(4-ethylphenoxy)-, (2R)-
CAS No:153545-91-6
MF:C11H14O3
MW:194.227063655853
CID:1327704
Update Time:2024-08-18
Propanoic acid, 2-(4-ethylphenoxy)-, (2R)- Chemical and Physical Properties
Names and Identifiers
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- Propanoic acid, 2-(4-ethylphenoxy)-, (2R)-
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- Inchi： 1S/C11H14O3/c1-3-9-4-6-10(7-5-9)14-8(2)11(12)13/h4-8H,3H2,1-2H3,(H,12,13)/t8-/m1/s1
- InChI Key： OSZYRPFCAFFXIF-MRVPVSSYSA-N
- SMILES： C(O)(=O)[C@H](OC1=CC=C(CC)C=C1)C
Computed Properties
- Exact Mass: 194.09432
Experimental Properties
- Density: 1.114±0.06 g/cm3(Predicted)
- Boiling Point: 316.3±17.0 °C(Predicted)
- PSA: 46.53
- pka: 3.26±0.10(Predicted)
Propanoic acid, 2-(4-ethylphenoxy)-, (2R)- Related Literature
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Dhamodaran Manikandan,S. Amirthapandian,I. S. Zhidkov,A. I. Kukharenko,S. O. Cholakh,Ramaswamy Murugan Phys. Chem. Chem. Phys., 2018,20, 6500-6514
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Bidou Wang,Xifeng Chen Analyst, 2014,139, 5695-5699
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Kathrin Kutlescha,Rhett Kempe New J. Chem., 2010,34, 1954-1960
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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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