Cas no 63818-27-9 (Hexanoic acid, 2-hydroxy-2-methyl-, ethyl ester)
63818-27-9 structure
Product Name:Hexanoic acid, 2-hydroxy-2-methyl-, ethyl ester
CAS No:63818-27-9
MF:C9H18O3
MW:174.237423419952
CID:1658786
Update Time:2024-09-12
Hexanoic acid, 2-hydroxy-2-methyl-, ethyl ester Chemical and Physical Properties
Names and Identifiers
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- Hexanoic acid, 2-hydroxy-2-methyl-, ethyl ester
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- Inchi： 1S/C9H18O3/c1-4-6-7-9(3,11)8(10)12-5-2/h11H,4-7H2,1-3H3
- InChI Key： QHGFBTYBHKORRS-UHFFFAOYSA-N
- SMILES： C(OCC)(=O)C(O)(C)CCCC
Computed Properties
- Exact Mass: 174.12564
Experimental Properties
- Density: 0.978±0.06 g/cm3(Predicted)
- Boiling Point: 91-93 °C(Press: 25 Torr)
- PSA: 46.53
- pka: 13.28±0.29(Predicted)
Hexanoic acid, 2-hydroxy-2-methyl-, ethyl ester Related Literature
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Eunice Y.-L. Hui,Bhimsen Rout,Yaw Sing Tan,Kok-Ping Chan,Charles W. Johannes Org. Biomol. Chem., 2018,16, 389-392
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Luis Miguel Azofra,Douglas R. MacFarlane,Chenghua Sun Chem. Commun., 2016,52, 3548-3551
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Yang Chen,Di Zhou,Zheyi Meng,Jin Zhai Chem. Commun., 2016,52, 10020-10023
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Govind Reddy Mol. Syst. Des. Eng., 2021,6, 779-789
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Xue-Ying Wang,Ying Pei,Min Xie,Zi-He Jin,Ya-Shi Xiao,Yang Wang,Li-Na Zhang,Yan Li,Wei-Hua Huang Lab Chip, 2015,15, 1178-1187
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