Cas no 73590-26-8 (3-[[(1S)-1,3-dicarboxypropyl]carbamoyl]-3-hydroxy-pentanedioic acid)
![3-[[(1S)-1,3-dicarboxypropyl]carbamoyl]-3-hydroxy-pentanedioic acid structure](https://ossimg.kuujia.com/scimg/74000/73590-26-8x500.png)
73590-26-8 structure
Product Name:3-[[(1S)-1,3-dicarboxypropyl]carbamoyl]-3-hydroxy-pentanedioic acid
CAS No:73590-26-8
MF:C11H15NO10
MW:321.237504243851
CID:563811
Update Time:2024-03-05
3-[[(1S)-1,3-dicarboxypropyl]carbamoyl]-3-hydroxy-pentanedioic acid Chemical and Physical Properties
Names and Identifiers
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- 3-[[(1S)-1,3-dicarboxypropyl]carbamoyl]-3-hydroxy-pentanedioic acid
- L-Glutamic acid, N-[3-carboxy-2-(carboxymethyl)-2-hydroxy-1-oxopropyl]-
-
- Inchi： 1S/C11H15NO10/c13-6(14)2-1-5(9(19)20)12-10(21)11(22,3-7(15)16)4-8(17)18/h5,22H,1-4H2,(H,12,21)(H,13,14)(H,15,16)(H,17,18)(H,19,20)/t5-/m0/s1
- InChI Key： GAQNUGISBQJMKO-YFKPBYRVSA-N
- SMILES： C(O)(=O)[C@H](CCC(O)=O)NC(=O)C(CC(O)=O)(O)CC(O)=O
Computed Properties
- Exact Mass: 321.07
- Monoisotopic Mass: 321.07
- Isotope Atom Count: 0
- Hydrogen Bond Donor Count: 6
- Hydrogen Bond Acceptor Count: 10
- Heavy Atom Count: 22
- Rotatable Bond Count: 10
- Complexity: 469
- Covalently-Bonded Unit Count: 1
- Defined Atom Stereocenter Count: 1
- Undefined Atom Stereocenter Count : 0
- Defined Bond Stereocenter Count: 0
- Undefined Bond Stereocenter Count: 0
Experimental Properties
- Density: 1.668
- Boiling Point: 730.7°C at 760 mmHg
- Flash Point: 395.7°C
- Refractive Index: 1.583
- pka: 2.92±0.10(Predicted)
3-[[(1S)-1,3-dicarboxypropyl]carbamoyl]-3-hydroxy-pentanedioic acid Related Literature
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Fereshteh Bayat Environ. Sci.: Nano, 2021,8, 367-389
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Guang Xu,Wei Zhang,Ying Zhang,Xiaoxia Zhao,Ping Wen,Di Ma RSC Adv., 2018,8, 19353-19361
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Yiding Jiao,Liqun Kang,Jasper Berry-Gair,Kit McColl,Jianwei Li,Haobo Dong,Hao Jiang,Ryan Wang,Furio Corà,Dan J. L. Brett,Ivan P. Parkin J. Mater. Chem. A, 2020,8, 22075-22082
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Marcin Czapla,Jack Simons Phys. Chem. Chem. Phys., 2018,20, 21739-21745
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Byungho Lim,Jaewon Jin,Jin Yoo,Seung Yong Han,Kyeongyeol Kim,Sungah Kang,Nojin Park,Sang Moon Lee,Hae Jin Kim,Seung Uk Son Chem. Commun., 2014,50, 7723-7726
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