Cas no 62062-61-7 (L-Aspartic acid, 1-butyl ester, hydrochloride)
62062-61-7 structure
Product Name:L-Aspartic acid, 1-butyl ester, hydrochloride
CAS No:62062-61-7
MF:C8H16ClNO4
MW:225.669941902161
CID:459343
PubChem ID:71390330
Update Time:2025-04-19
L-Aspartic acid, 1-butyl ester, hydrochloride Chemical and Physical Properties
Names and Identifiers
-
- L-Aspartic acid, 1-butyl ester, hydrochloride
- (3S)-3-amino-4-butoxy-4-oxobutanoic acid,hydrochloride
- (3S)-3-Amino-4-butoxy-4-oxobutanoic acid--hydrogen chloride (1/1) (non-preferred name)
- DTXSID00812241
- SCHEMBL5709063
- 62062-61-7
-
- Inchi： 1S/C8H15NO4.ClH/c1-2-3-4-13-8(12)6(9)5-7(10)11;/h6H,2-5,9H2,1H3,(H,10,11);1H/t6-;/m0./s1
- InChI Key： NWGZCSSMNJJLEX-RGMNGODLSA-N
- SMILES： Cl.O(C([C@H](CC(=O)O)N)=O)CCCC
Computed Properties
- Exact Mass: 225.07688
- Monoisotopic Mass: 225.0767857g/mol
- Isotope Atom Count: 0
- Hydrogen Bond Donor Count: 3
- Hydrogen Bond Acceptor Count: 5
- Heavy Atom Count: 14
- Rotatable Bond Count: 7
- Complexity: 181
- Covalently-Bonded Unit Count: 2
- Defined Atom Stereocenter Count: 1
- Undefined Atom Stereocenter Count : 0
- Defined Bond Stereocenter Count: 0
- Undefined Bond Stereocenter Count: 0
- Topological Polar Surface Area: 89.6?2
Experimental Properties
- PSA: 89.62
L-Aspartic acid, 1-butyl ester, hydrochloride Related Literature
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Gaurav J. Shah,Eric P.-Y. Chiou,Ming C. Wu,Chang-Jin “CJ” Kim Lab Chip, 2009,9, 1732-1739
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Vishwesh Venkatraman,Marco Foscato,Vidar R. Jensen,Bj?rn K?re Alsberg J. Mater. Chem. A, 2015,3, 9851-9860
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Tengfei Yu,Yuehan Wu,Wei Li,Bin Li RSC Adv., 2014,4, 34134-34143
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Yaling Zhang,Chunhui Dai,Shiwei Zhou,Bin Liu Chem. Commun., 2018,54, 10092-10095
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Tao Wang,Yangyang Liu,Yue Deng,Hongbo Fu,Jianmin Chen Environ. Sci.: Nano, 2018,5, 1821-1833
62062-61-7 (L-Aspartic acid, 1-butyl ester, hydrochloride) Related Products
- 764724-38-1(ethyl 2-amino-4-hydroxybutanoate)
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- 13552-87-9(L-Aspartic acid,1,4-diethyl ester)
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- 65414-78-0(D-Aspartic Acid 1-Methyl Ester)
- 6384-18-5(L-Aspartic acid,1,4-dimethyl ester)
- 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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