Cas no 112196-49-3 (L-Alanine, N-[(1,1-dimethylethoxy)carbonyl]-D-alanyl-)
![L-Alanine, N-[(1,1-dimethylethoxy)carbonyl]-D-alanyl- structure](https://ossimg.kuujia.com/scimg/112500/112196-49-3x500.png)
112196-49-3 structure
Product Name:L-Alanine, N-[(1,1-dimethylethoxy)carbonyl]-D-alanyl-
CAS No:112196-49-3
MF:C11H20N2O5
MW:260.286903381348
CID:1199836
PubChem ID:14018925
Update Time:2025-04-20
L-Alanine, N-[(1,1-dimethylethoxy)carbonyl]-D-alanyl- Chemical and Physical Properties
Names and Identifiers
-
- L-Alanine, N-[(1,1-dimethylethoxy)carbonyl]-D-alanyl-
- (S)-2-((R)-2-tert-butoxycarbonylamino-1-hydroxy-propylamino)-propionic acid
- BOCNH-D-Ala-L-Ala-OH
- (2S)-2-[(2R)-2-[(tert-butoxycarbonyl)amino]propanamido]propanoic acid
- (S)-2-((R)-2-tert-butoxycarbonylamino-1-hydroxy-propylamino)-propionic acid BOCNH-D-Ala-L-Ala-OH
- 112196-49-3
- SCHEMBL9980754
-
- Inchi： 1S/C11H20N2O5/c1-6(8(14)12-7(2)9(15)16)13-10(17)18-11(3,4)5/h6-7H,1-5H3,(H,12,14)(H,13,17)(H,15,16)/t6-,7+/m1/s1
- InChI Key： BZNDDHWTEVCBAD-RQJHMYQMSA-N
- SMILES： O(C(N[C@H](C)C(N[C@H](C(=O)O)C)=O)=O)C(C)(C)C
Computed Properties
- Exact Mass: 260.1373
- Monoisotopic Mass: 260.13722174g/mol
- Isotope Atom Count: 0
- Hydrogen Bond Donor Count: 3
- Hydrogen Bond Acceptor Count: 7
- Heavy Atom Count: 18
- Rotatable Bond Count: 8
- Complexity: 335
- Covalently-Bonded Unit Count: 1
- Defined Atom Stereocenter Count: 2
- Undefined Atom Stereocenter Count : 0
- Defined Bond Stereocenter Count: 0
- Undefined Bond Stereocenter Count: 0
- XLogP3: 0.7
- Topological Polar Surface Area: 105?2
Experimental Properties
- PSA: 104.73
L-Alanine, N-[(1,1-dimethylethoxy)carbonyl]-D-alanyl- Related Literature
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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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Gang Pan,Yi-jie Bao,Jie Xu,Tao Liu,Cheng Liu,Yan-yan Qiu,Xiao-jing Shi,Hui Yu,Ting-ting Jia,Xia Yuan,Ze-ting Yuan,Yi-jun Cao RSC Adv., 2016,6, 42109-42119
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Jacob S. Jordan,Evan R. Williams Analyst, 2021,146, 2617-2625
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Tao Wang,Yangyang Liu,Yue Deng,Hongbo Fu,Jianmin Chen Environ. Sci.: Nano, 2018,5, 1821-1833
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Partha Laskar,Christine Dufès Nanoscale Adv., 2021,3, 6007-6026
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