Cas no 70396-19-9 (L-Alanine, N-[N-[(1,1-dimethylethoxy)carbonyl]-L-isoleucyl]-)
![L-Alanine, N-[N-[(1,1-dimethylethoxy)carbonyl]-L-isoleucyl]- structure](https://ossimg.kuujia.com/scimg/70500/70396-19-9x500.png)
70396-19-9 structure
Product Name:L-Alanine, N-[N-[(1,1-dimethylethoxy)carbonyl]-L-isoleucyl]-
CAS No:70396-19-9
MF:C14H26N2O5
MW:302.366644382477
CID:547297
PubChem ID:71404961
Update Time:2025-04-19
L-Alanine, N-[N-[(1,1-dimethylethoxy)carbonyl]-L-isoleucyl]- Chemical and Physical Properties
Names and Identifiers
-
- L-Alanine, N-[N-[(1,1-dimethylethoxy)carbonyl]-L-isoleucyl]-
- (2S)-2-[[(2S,3S)-3-methyl-2-[(2-methylpropan-2-yl)oxycarbonylamino]pentanoyl]amino]propanoic acid
- t-butyloxycarbonyl-isoleucyl-alanine
- N-(tert-Butoxycarbonyl)-L-isoleucyl-L-alanine
- DTXSID00825775
- 70396-19-9
- SCHEMBL9980656
-
- Inchi： 1S/C14H26N2O5/c1-7-8(2)10(11(17)15-9(3)12(18)19)16-13(20)21-14(4,5)6/h8-10H,7H2,1-6H3,(H,15,17)(H,16,20)(H,18,19)/t8-,9-,10-/m0/s1
- InChI Key： QSTHWZRQUMSZKK-GUBZILKMSA-N
- SMILES： O(C(N[C@H](C(N[C@H](C(=O)O)C)=O)[C@@H](C)CC)=O)C(C)(C)C
Computed Properties
- Exact Mass: 302.18428
- Monoisotopic Mass: 302.18417193g/mol
- Isotope Atom Count: 0
- Hydrogen Bond Donor Count: 3
- Hydrogen Bond Acceptor Count: 5
- Heavy Atom Count: 21
- Rotatable Bond Count: 8
- Complexity: 389
- Covalently-Bonded Unit Count: 1
- Defined Atom Stereocenter Count: 3
- Undefined Atom Stereocenter Count : 0
- Defined Bond Stereocenter Count: 0
- Undefined Bond Stereocenter Count: 0
- XLogP3: 2
- Topological Polar Surface Area: 105?2
Experimental Properties
- PSA: 104.73
L-Alanine, N-[N-[(1,1-dimethylethoxy)carbonyl]-L-isoleucyl]- Related Literature
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Xiaoming Liu,Zachary D. Hood,Wangda Li,Donovan N. Leonard,Arumugam Manthiram,Miaofang Chi J. Mater. Chem. A, 2021,9, 2111-2119
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Alexandre Vimont,Arnaud Travert,Philippe Bazin,Jean-Claude Lavalley,Marco Daturi,Christian Serre,Gérard Férey,Sandrine Bourrelly,Philip L. Llewellyn Chem. Commun., 2007, 3291-3293
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Goonay Yousefalizadeh,Shideh Ahmadi,Nicholas J. Mosey,Kevin G. Stamplecoskie Nanoscale, 2021,13, 242-252
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Amit Kumar Majhi,Subbarao Kanchi,V. Venkataraman,K. G. Ayappa,Prabal K. Maiti Soft Matter, 2015,11, 8632-8640
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