Cas no 28315-50-6 (Benzoic acid, p-(b-D-glucopyranosylamino)-, ethylester (8CI))

Benzoic acid, p-(b-D-glucopyranosylamino)-, ethylester (8CI) structure
28315-50-6 structure
Product Name:Benzoic acid, p-(b-D-glucopyranosylamino)-, ethylester (8CI)
CAS No:28315-50-6
MF:C15H21NO7
MW:327.329745054245
CID:252007
PubChem ID:71313694
Update Time:2025-09-23

Benzoic acid, p-(b-D-glucopyranosylamino)-, ethylester (8CI) Chemical and Physical Properties

Names and Identifiers

    • Benzoic acid, p-(b-D-glucopyranosylamino)-, ethylester (8CI)
    • Benzocaine N-β-D-Glucoside
    • BENZOCAINE GLUCOSIDE
    • ethyl 4-[[(2R,4S,5S)-3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]amino]benzoate
    • 4-D-Glucit-1-ylidenamino-benzoesaeure-aethylester
    • A-D-Glucoside
    • Benzocaine N-
    • Benzocaine N-glucoside
    • N-Glucoanesthesin
    • N-[4-(Ethoxycarbonyl)phenyl]-beta-D-threo-hexopyranosylamine
    • Benzocaine-N-Beta-D-Glucoside
    • ethyl 4-[[(2R, 4S, 5S)-3, 4, 5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]amino]benzoate
    • 28315-50-6
    • DTXSID40747088
    • ETHYL 4-{[(2R,4S,5S)-3,4,5-TRIHYDROXY-6-(HYDROXYMETHYL)OXAN-2-YL]AMINO}BENZOATE
    • Inchi: 1S/C15H21NO7/c1-2-22-15(21)8-3-5-9(6-4-8)16-14-13(20)12(19)11(18)10(7-17)23-14/h3-6,10-14,16-20H,2,7H2,1H3/t10?,11-,12+,13?,14-/m1/s1
    • InChI Key: FREAPVFREJJKCA-OONHEIRLSA-N
    • SMILES: O1[C@H](C([C@H]([C@@H](C1CO)O)O)O)NC1C=CC(C(=O)OCC)=CC=1

Computed Properties

  • Exact Mass: 327.13200
  • Monoisotopic Mass: 327.13180201g/mol
  • Isotope Atom Count: 0
  • Hydrogen Bond Donor Count: 5
  • Hydrogen Bond Acceptor Count: 8
  • Heavy Atom Count: 23
  • Rotatable Bond Count: 6
  • Complexity: 386
  • Covalently-Bonded Unit Count: 1
  • Defined Atom Stereocenter Count: 3
  • Undefined Atom Stereocenter Count : 2
  • Defined Bond Stereocenter Count: 0
  • Undefined Bond Stereocenter Count: 0
  • XLogP3: 0
  • Topological Polar Surface Area: 129?2

Experimental Properties

  • PSA: 128.48000
  • LogP: -0.85190

Benzoic acid, p-(b-D-glucopyranosylamino)-, ethylester (8CI) Pricemore >>

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