Cas no 42852-95-9 (a-L-Glucopyranose,2-deoxy-2-(methylamino)-)
42852-95-9 structure
Product Name:a-L-Glucopyranose,2-deoxy-2-(methylamino)-
CAS No:42852-95-9
MF:C7H15NO5
MW:193.197702646255
CID:325256
PubChem ID:520619
Update Time:2025-04-19
a-L-Glucopyranose,2-deoxy-2-(methylamino)- Chemical and Physical Properties
Names and Identifiers
-
- a-L-Glucopyranose,2-deoxy-2-(methylamino)-
- (4S,6S)-6-(hydroxymethyl)-3-(methylamino)tetrahydro-2H-pyran-2,4,5-triol
- N-METHYL-D-GLUCOSAMINE
- AKOS006276132
- 42852-95-9
- SCHEMBL2557485
-
- Inchi： 1S/C7H15NO5/c1-8-4(2-9)6(12)7(13)5(11)3-10/h2,4-8,10-13H,3H2,1H3
- InChI Key： LDDMACCNBZAMSG-UHFFFAOYSA-N
- SMILES： OC(C(C=O)NC)C(C(CO)O)O
Computed Properties
- Exact Mass: 193.09502258g/mol
- Monoisotopic Mass: 193.09502258g/mol
- Isotope Atom Count: 0
- Hydrogen Bond Donor Count: 5
- Hydrogen Bond Acceptor Count: 6
- Heavy Atom Count: 13
- Rotatable Bond Count: 6
- Complexity: 154
- Covalently-Bonded Unit Count: 1
- Defined Atom Stereocenter Count: 0
- Undefined Atom Stereocenter Count : 4
- Defined Bond Stereocenter Count: 0
- Undefined Bond Stereocenter Count: 0
- XLogP3: -3.2
- Topological Polar Surface Area: 110?2
Experimental Properties
- Density: 1.3109 (rough estimate)
- Boiling Point: 329.41°C (rough estimate)
- Refractive Index: 1.4500 (estimate)
- Specific Rotation: D25 -62° (c = 1 in methanol)
a-L-Glucopyranose,2-deoxy-2-(methylamino)- Related Literature
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Sandip Gangadhar Balwe,Yeon Tae Jeong Org. Biomol. Chem., 2018,16, 1287-1296
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S. Amaresh,K. Karthikeyan,K. J. Kim,Y. S. Lee RSC Adv., 2014,4, 23107-23115
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Mark D. Allendorf,Alauddin Ahmed,Tom Autrey,Jeffrey Camp,Eun Seon Cho,Maciej Haranczyk,Abhi Karkamkar,Di-Jia Liu,Katie R. Meihaus,Iffat H. Nayyar,Roman Nazarov,Donald J. Siegel,Vitalie Stavila,Jeffrey J. Urban,Srimukh Prasad Veccham,Brandon C. Wood Energy Environ. Sci., 2018,11, 2784-2812
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Juan J. Sánchez,Miguel López-Haro,Juan C. Hernández-Garrido,Ginesa Blanco,Miguel A. Cauqui,José M. Rodríguez-Izquierdo,José A. Pérez-Omil,José J. Calvino,María P. Yeste J. Mater. Chem. A, 2019,7, 8993-9003
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