Cas no 176650-17-2 (1,4-Butanediol, 2-propyl-, (2S)-)
176650-17-2 structure
Product Name:1,4-Butanediol, 2-propyl-, (2S)-
CAS No:176650-17-2
MF:C7H16O2
MW:132.200742721558
CID:1363279
Update Time:2024-08-17
1,4-Butanediol, 2-propyl-, (2S)- Chemical and Physical Properties
Names and Identifiers
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- 1,4-Butanediol, 2-propyl-, (2S)-
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- Inchi： 1S/C7H16O2/c1-2-3-7(6-9)4-5-8/h7-9H,2-6H2,1H3/t7-/m0/s1
- InChI Key： LPEVSCRXBSHMOZ-ZETCQYMHSA-N
- SMILES： C(O)[C@@H](CCC)CCO
Computed Properties
- Exact Mass: 132.11508
Experimental Properties
- Density: 0.947±0.06 g/cm3(Predicted)
- Boiling Point: 236.1±8.0 °C(Predicted)
- PSA: 40.46
- pka: 14.91±0.10(Predicted)
1,4-Butanediol, 2-propyl-, (2S)- Related Literature
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Chen Long,Ying Dai,Jianwei Li,Hao Jin Nanoscale, 2020,12, 21124-21130
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Matthew J. Gaunt,Jinquan Yu,Jonathan B. Spencer Chem. Commun., 2001, 1844-1845
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Eric Besson,Stéphane Gastaldi,Emily Bloch,Selma Aslan,Hakim Karoui,Olivier Ouari,Micael Hardy Analyst, 2019,144, 4194-4203
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5. Estimating and correcting interference fringes in infrared spectra in infrared hyperspectral imagingGhazal Azarfar,Ebrahim Aboualizadeh,Nicholas M. Walter,Simona Ratti,Camilla Olivieri,Alessandra Norici,Michael Nasse,Achim Kohler,Mario Giordano Analyst, 2018,143, 4674-4683
176650-17-2 (1,4-Butanediol, 2-propyl-, (2S)-) Related Products
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