Cas no 2439-38-5 (L-Isoleucine, N,N-dimethyl-)
L-Isoleucine, N,N-dimethyl- structure
Product Name:L-Isoleucine, N,N-dimethyl-
CAS No:2439-38-5
MF:C8H17NO2
MW:159.2260825634
CID:1417462
PubChem ID:11768849
Update Time:2025-04-20
L-Isoleucine, N,N-dimethyl- Chemical and Physical Properties
Names and Identifiers
-
- L-Isoleucine, N,N-dimethyl-
- (2S,3S)-2-(dimethylamino)-3-methylpentanoic acid
- 2439-38-5
- SCHEMBL196730
- N,N-dimethyl isoleucine
- DTXSID80472069
- n,n-dimethylisoleucine
-
- Inchi： 1S/C8H17NO2/c1-5-6(2)7(8(10)11)9(3)4/h6-7H,5H2,1-4H3,(H,10,11)/t6-,7-/m0/s1
- InChI Key： OQJJVXKMPUJFJK-BQBZGAKWSA-N
- SMILES： OC([C@H]([C@@H](C)CC)N(C)C)=O
Computed Properties
- Exact Mass: 159.12601
- Monoisotopic Mass: 159.125928785g/mol
- Isotope Atom Count: 0
- Hydrogen Bond Donor Count: 1
- Hydrogen Bond Acceptor Count: 3
- Heavy Atom Count: 11
- Rotatable Bond Count: 4
- Complexity: 134
- 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: 40.5?2
Experimental Properties
- PSA: 40.54
L-Isoleucine, N,N-dimethyl- Related Literature
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Bo Wei,Zhenyu Liu,Chen Xie,Shu Yang,Wentao Tang,Aiwei Gu,Wing-Tak Wong,Ka-Leung Wong J. Mater. Chem. C, 2015,3, 12322-12327
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Eunju Nam,Jiyeon Han,Sunhee Choi,Mi Hee Lim Chem. Commun., 2021,57, 7637-7640
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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
-
Fereshteh Bayat Environ. Sci.: Nano, 2021,8, 367-389
2439-38-5 (L-Isoleucine, N,N-dimethyl-) Related Products
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