Cas no 42031-13-0 (Butyl 2-amino-4-methylpentanoate)
42031-13-0 structure
Product Name:Butyl 2-amino-4-methylpentanoate
CAS No:42031-13-0
MF:C10H21NO2
MW:187.27924323082
CID:1516475
PubChem ID:413337
Update Time:2025-04-21
Butyl 2-amino-4-methylpentanoate Chemical and Physical Properties
Names and Identifiers
-
- Butyl 2-amino-4-methylpentanoate
- AC1L95BR
- AG-F-49452
- DL-Leucine, butyl ester
- DL-leucine 1-butyl ester hydrochloride
- Leucine, butyl ester
- AGN-PC-00NMGF
- BUTYL 2-AMINO-4-METHYL-PENTANOATE
- AKOS009411804
- L-leucine butyl ester, hydrochloride
- L-leucine butyl ester hydrochloride
- L-Leucin-butylester, Hydrochlorid
- CTK4I5589
- AC1L95BR; AG-F-49452; DL-Leucine, butyl ester; DL-leucine 1-butyl ester hydrochloride; Leucine, butyl ester; AGN-PC-00NMGF; BUTYL 2-AMINO-4-METHYL-PENTANOATE; AKOS009411804; L-leucine butyl ester, hydrochloride; L-leucine butyl ester hydrochloride; L-Leucin-butylester, Hydrochlorid; CTK4I5589;
- SCHEMBL8964483
- L-Leucine, butyl ester
- HYPLQEHLQMSBKE-UHFFFAOYSA-N
- 42031-13-0
- Leucine butyl ester
- DTXSID70328703
-
- Inchi： 1S/C10H21NO2/c1-4-5-6-13-10(12)9(11)7-8(2)3/h8-9H,4-7,11H2,1-3H3
- InChI Key： HYPLQEHLQMSBKE-UHFFFAOYSA-N
- SMILES： O(CCCC)C(C(CC(C)C)N)=O
Computed Properties
- Exact Mass: 187.15733
- Monoisotopic Mass: 187.157228913g/mol
- Isotope Atom Count: 0
- Hydrogen Bond Donor Count: 1
- Hydrogen Bond Acceptor Count: 3
- Heavy Atom Count: 13
- Rotatable Bond Count: 7
- Complexity: 146
- 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: 2.2
- Topological Polar Surface Area: 52.3?2
Experimental Properties
- PSA: 52.32
Butyl 2-amino-4-methylpentanoate Related Literature
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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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Eléonore Resongles,Corinne Casiot,Fran?oise Elbaz-Poulichet,Rémi Freydier,Odile Bruneel,Christine Piot,Sophie Delpoux,Aurélie Volant,Angélique Desoeuvre Environ. Sci.: Processes Impacts, 2013,15, 1536-1544
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Guiying Zhang,Maosheng Cheng,Yanni Li,Keliang Liu,Lifeng Cai Chem. Commun., 2013,49, 11086-11088
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Andreas Nenning,Manuel Holzmann,Jürgen Fleig,Alexander K. Opitz Mater. Adv., 2021,2, 5422-5431
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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
42031-13-0 (Butyl 2-amino-4-methylpentanoate) Related Products
- 25456-76-2(H-D-Glu-OtBu)
- 2748-02-9(L-Leucine tert-butyl ester hydrochloride)
- 16450-41-2(L-Glutamic acid,1,5-diethyl ester)
- 1119-33-1(H-Glu(OEt)-OH)
- 2577-46-0((2S,3S)-Methyl 2-amino-3-methylpentanoate)
- 15911-75-8(tert-butyl (2S)-2-aminopentanoate)
- 13893-47-5(Ethyl 2-amino-2-methylpentanoate)
- 152802-65-8(Ethyl 2-amino-2-ethylhexanoate)
- 332062-08-5(Fmoc-S-3-amino-4,4-diphenyl-butyric acid)
- 1270529-38-8(1,2,3,4,5,6-Hexahydro-[2,3]bipyridinyl-6-ol)
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