Cas no 179795-14-3 (L-Isoleucine, N-(1-carboxyethyl)-, (R)-)
179795-14-3 structure
Product Name:L-Isoleucine, N-(1-carboxyethyl)-, (R)-
CAS No:179795-14-3
MF:C9H17NO4
MW:203.23558306694
CID:1375701
Update Time:2024-08-16
L-Isoleucine, N-(1-carboxyethyl)-, (R)- Chemical and Physical Properties
Names and Identifiers
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- L-Isoleucine, N-(1-carboxyethyl)-, (R)-
- L-Isoleucine, N-(1-carboxyethyl)-, (R)- (9CI)
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- Inchi： 1S/C9H17NO4/c1-4-5(2)7(9(13)14)10-6(3)8(11)12/h5-7,10H,4H2,1-3H3,(H,11,12)(H,13,14)/t5-,6+,7-/m0/s1
- InChI Key： SGRBVWIYXFFROW-XVMARJQXSA-N
- SMILES： C(O)(=O)[C@H]([C@@H](C)CC)N[C@@H](C(O)=O)C
Computed Properties
- Exact Mass: 203.11581
Experimental Properties
- Density: 1.152±0.06 g/cm3(Predicted)
- Boiling Point: 362.1±27.0 °C(Predicted)
- PSA: 86.63
- pka: 2.15±0.10(Predicted)
L-Isoleucine, N-(1-carboxyethyl)-, (R)- Related Literature
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Tanya Ostapenko,Peter J. Collings,Samuel N. Sprunt,J. T. Gleeson Soft Matter, 2013,9, 9487-9498
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Huabin Zhang,Shaowu Du CrystEngComm, 2014,16, 4059-4068
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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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Rongyan Guo,Tao Li,Shuie Shi J. Mater. Chem. C, 2019,7, 5148-5154
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Hamid Heydari,Mohammad B. Gholivand New J. Chem., 2017,41, 237-244
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