Cas no 98064-96-1 (Hexadecyl β-D-maltoside)

Hexadecyl β-D-maltoside structure
Hexadecyl β-D-maltoside structure
Product Name:Hexadecyl β-D-maltoside
CAS No:98064-96-1
MF:C28H54O11
MW:566.721770763397
CID:801567
PubChem ID:24874303
Update Time:2025-04-19

Hexadecyl β-D-maltoside Chemical and Physical Properties

Names and Identifiers

    • b-D-Glucopyranoside, hexadecyl4-O-a-D-glucopyranosyl-
    • (2R,3R,4S,5S,6R)-2-[(2R,3S,4R,5R,6R)-6-hexadecoxy-4,5-dihydroxy-2-(hydroxymethyl)oxan-3-yl]oxy-6-(hydroxymethyl)oxane-3,4,5-triol
    • n-Hexadecyl β-D-maltoside
    • A-D-maltoside
    • Cetyl
    • Hexadecyl-
    • n-Hexadecyl
    • Hexadecyl 4-O-α-D-glucopyranosyl-β-D-glucopyranoside
    • Hexadecyl β-D-maltoside
    • Hexadecyl β-maltoside
    • n-hexadecyl-beta-d-maltoside
    • HY-W020795
    • E80899
    • (2R,3R,4S,5S,6R)-2-(((2R,3S,4R,5R,6R)-6-(Hexadecyloxy)-4,5-dihydroxy-2-(hydroxymethyl)tetrahydro-2H-pyran-3-yl)oxy)-6-(hydroxymethyl)tetrahydro-2H-pyran-3,4,5-triol
    • W-204170
    • HEXADECYL BETA-D-MALTOPYRANOSIDE
    • HEXADECYLBETA-D-MALTOPYRANOSIDE
    • Hexadecyl-beta-D-maltoside
    • Hexadecyl
    • n-Hexadecyl beta -D-maltoside
    • Cetyl beta-D-maltoside
    • 98064-96-1
    • DTXSID10431760
    • Hexadecyl b-D-maltopyranoside
    • MFCD01310880
    • n-Hexadecyl beta-D-maltoside
    • n-Hexadecyl-I(2)-D-maltoside
    • n-Hexadecyl beta-D-maltoside, >=99.0% (TLC)
    • BS-44730
    • CS-0031954
    • hexadecyl--d-maltoside 0.1 mm solu
    • DA-74104
    • MDL: MFCD01310880
    • Inchi: 1S/C28H54O11/c1-2-3-4-5-6-7-8-9-10-11-12-13-14-15-16-36-27-25(35)23(33)26(20(18-30)38-27)39-28-24(34)22(32)21(31)19(17-29)37-28/h19-35H,2-18H2,1H3/t19-,20-,21-,22+,23-,24-,25-,26-,27-,28-/m1/s1
    • InChI Key: GTQCHJYVKDXMRU-YMEALESQSA-N
    • SMILES: O([C@@H]1[C@@H]([C@H]([C@@H]([C@@H](CO)O1)O)O)O)[C@@H]1[C@@H](CO)O[C@H]([C@@H]([C@H]1O)O)OCCCCCCCCCCCCCCCC

Computed Properties

  • Exact Mass: 566.36700
  • Monoisotopic Mass: 566.36661253g/mol
  • Isotope Atom Count: 0
  • Hydrogen Bond Donor Count: 7
  • Hydrogen Bond Acceptor Count: 11
  • Heavy Atom Count: 39
  • Rotatable Bond Count: 20
  • Complexity: 612
  • Covalently-Bonded Unit Count: 1
  • Defined Atom Stereocenter Count: 10
  • Undefined Atom Stereocenter Count : 0
  • Defined Bond Stereocenter Count: 0
  • Undefined Bond Stereocenter Count: 0
  • XLogP3: 3.6
  • Topological Polar Surface Area: 179?2

Experimental Properties

  • Color/Form: No data available
  • Melting Point: No data available
  • Boiling Point: 733.3±60.0 °C at 760 mmHg
  • Flash Point: 397.3±32.9 °C
  • PSA: 178.53000
  • LogP: 1.10840
  • Sensitiveness: Moisture Sensitive

Hexadecyl β-D-maltoside Customs Data

  • HS CODE:29400090

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Hexadecyl β-D-maltoside Production Method

Production Method 1

Reaction Conditions
1.1R:AcONa
2.1R:PhCH2NH2, S:THF, 6 h, rt
2.2R:AcOH, rt, pH 6-7
3.1R:DBU, S:CH2Cl2, 0°C; 7 h, 0°C
4.1R:BF3-Et2O, S:CH2Cl2, 0°C; 6 h, 0°C
5.1R:NaOMe, S:MeOH, 3 h, rt, pH 10
5.2rt, pH 7
Reference
Solution Properties of Alkyl β-D-Maltosides
By Li, Zhencao et al, Journal of Surfactants and Detergents, 2019, 22(4), 731-742

Production Method 2

Reaction Conditions
1.1R:BF3-Et2O, S:CH2Cl2, 2 h, 0°C; 0°C → rt
2.1R:NaOMe, S:MeOH, 1 h, rt
2.2R:DOWEX 50W, rt, neutralized
Reference
Hydrophobic tail length, degree of fluorination and headgroup stereochemistry are determinants of the biocompatibility of (fluorinated) carbohydrate surfactants
By Li, Xueshu et al, Colloids and Surfaces, 2009, 73(1), 65-74

Production Method 3

Reaction Conditions
1.1R:Acetyl bromide, R:AcOH, S:H2O, 0.5 h, rt
1.2R:FeCl3, S:MeCN, 1 h, rt
1.3R:KBr, S:PhMe, rt
1.4R:NaOMe, S:MeOH, overnight, rt
1.5R:AcOH, S:H2O, rt
Reference
Simple preparations of alkyl and cycloalkyl α-glycosides of maltose, cellobiose, and lactose
By Koto, Shinkiti et al, Carbohydrate Research, 2004, 339(14), 2415-2424

Hexadecyl β-D-maltoside Raw materials

Hexadecyl β-D-maltoside Preparation Products

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