Cas no 28116-85-0 ((2S,3R)-2-Amino-3-methylhexanoic acid)
28116-85-0 structure
Product Name:(2S,3R)-2-Amino-3-methylhexanoic acid
CAS No:28116-85-0
MF:C7H15NO2
MW:145.199502229691
CID:2026264
PubChem ID:17753371
Update Time:2025-04-21
(2S,3R)-2-Amino-3-methylhexanoic acid Chemical and Physical Properties
Names and Identifiers
-
- (2S,3R)-2-Amino-3-methylhexanoic acid
- SCHEMBL3582073
- beta-Methylnorleucine
- 28116-85-0
- SKJ
- AKOS006339617
- (2~{S},3~{R})-2-azanyl-3-methyl-hexanoic acid
-
- Inchi： 1S/C7H15NO2/c1-3-4-5(2)6(8)7(9)10/h5-6H,3-4,8H2,1-2H3,(H,9,10)
- InChI Key： KWSUGULOZFMUDH-UHFFFAOYSA-N
- SMILES： CCCC(C(C(=O)O)N)C
Computed Properties
- Exact Mass: 145.110278721Da
- Monoisotopic Mass: 145.110278721Da
- Isotope Atom Count: 0
- Hydrogen Bond Donor Count: 2
- Hydrogen Bond Acceptor Count: 3
- Heavy Atom Count: 10
- Rotatable Bond Count: 4
- Complexity: 114
- 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: -1.2
- Topological Polar Surface Area: 63.3?2
(2S,3R)-2-Amino-3-methylhexanoic acid Related Literature
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Christian K. Rank,Alexander W. Jones,Tatjana Wall,Patrick Di Martino-Fumo,Sarah Schr?ck,Markus Gerhards,Frederic W. Patureau Chem. Commun., 2019,55, 13749-13752
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Sandip Gangadhar Balwe,Yeon Tae Jeong Org. Biomol. Chem., 2018,16, 1287-1296
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Ravi Kumar Yadav,R. Govindaraj Phys. Chem. Chem. Phys., 2020,22, 26876-26886
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Jing Chen,Yu Shao,Danzhen Li J. Mater. Chem. A, 2017,5, 937-941
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Benjamin Gabriel Poulson,Kacper Szczepski,Joanna Izabela Lachowicz,Lukasz Jaremko,Abdul-Hamid Emwas,Mariusz Jaremko RSC Adv., 2020,10, 215-227
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