Cas no 1113-67-3 (Amide-(()-2-Hydroxy-3-methylbutanoic acid)
1113-67-3 structure
Product Name:Amide-(()-2-Hydroxy-3-methylbutanoic acid
CAS No:1113-67-3
MF:C5H11NO2
MW:117.146341562271
CID:2021981
PubChem ID:12768404
Update Time:2025-04-21
Amide-(()-2-Hydroxy-3-methylbutanoic acid Chemical and Physical Properties
Names and Identifiers
-
- Amide-(()-2-Hydroxy-3-methylbutanoic acid
- AKOS011508299
- DTXSID201308780
- 2-hydroxy-3-methylbutanamide
- SCHEMBL3355488
- 1113-67-3
-
- Inchi： 1S/C5H11NO2/c1-3(2)4(7)5(6)8/h3-4,7H,1-2H3,(H2,6,8)
- InChI Key： WQPHBKCACJYXGG-UHFFFAOYSA-N
- SMILES： OC(C(N)=O)C(C)C
Computed Properties
- Exact Mass: 117.078978594Da
- Monoisotopic Mass: 117.078978594Da
- Isotope Atom Count: 0
- Hydrogen Bond Donor Count: 2
- Hydrogen Bond Acceptor Count: 2
- Heavy Atom Count: 8
- Rotatable Bond Count: 2
- Complexity: 90.4
- Covalently-Bonded Unit Count: 1
- Defined Atom Stereocenter Count: 0
- Undefined Atom Stereocenter Count : 1
- Defined Bond Stereocenter Count: 0
- Undefined Bond Stereocenter Count: 0
- XLogP3: -0.1
- Topological Polar Surface Area: 63.3?2
Amide-(()-2-Hydroxy-3-methylbutanoic acid Related Literature
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David White,Sean R. Stowell Biomater. Sci., 2017,5, 463-474
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Long Deng,Qian Zou,Biao Liu,Wenhui Ye,Chengfei Zhuo,Li Chen,Ze-Yuan Deng,Ya-Wei Fan,Jing Li Food Funct., 2018,9, 4234-4245
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Ji-Ping Wei Nanoscale, 2015,7, 11815-11832
-
Ana G. Neo,Ana Bornadiego,Jesús Díaz,Stefano Marcaccini,Carlos F. Marcos Org. Biomol. Chem., 2013,11, 6546-6555
1113-67-3 (Amide-(()-2-Hydroxy-3-methylbutanoic acid) Related Products
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