Structure

4-Nitrophenyl-alpha-D-galactopyranoside

CAS
7493-95-0
Catalog Number
ACM7493950
Category
Other Products
Molecular Weight
301.25
Molecular Formula
C12H15NO8

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Specification

Synonyms
alpha-d-galactopyranoside,4-nitrophenyl;4-NITROPHENYL-ALPHA-D-GALACTOPYRANOSIDE;GAL1-A-PNP;PNP-ALPHA-D-GAL;PNP ALPHA-D-GALACTOPYRANOSIDE;PNP-ALPHA-GAL;PNPG;P-NITROPHENYL A-D-GALACTOPYRANOSIDE
Melting Point
166-169°C
Hazard Statements
Xi
Safety Description
22-24/25-36-26
What is the molecular formula of 4-Nitrophenyl-alpha-D-galactopyranoside?

The molecular formula of 4-Nitrophenyl-alpha-D-galactopyranoside is C12H15NO8.

What is the molecular weight of 4-Nitrophenyl-alpha-D-galactopyranoside?

The molecular weight of 4-Nitrophenyl-alpha-D-galactopyranoside is 301.25 g/mol.

What is the IUPAC name of 4-Nitrophenyl-alpha-D-galactopyranoside?

The IUPAC name of 4-Nitrophenyl-alpha-D-galactopyranoside is (2R,3R,4S,5R,6R)-2-(hydroxymethyl)-6-(4-nitrophenoxy)oxane-3,4,5-triol.

What is the InChI of 4-Nitrophenyl-alpha-D-galactopyranoside?

The InChI of 4-Nitrophenyl-alpha-D-galactopyranoside is InChI=1S/C12H15NO8/c14-5-8-9(15)10(16)11(17)12(21-8)20-7-3-1-6(2-4-7)13(18)19/h1-4,8-12,14-17H,5H2/t8-,9+,10+,11-,12+/m1/s1.

What is the InChIKey of 4-Nitrophenyl-alpha-D-galactopyranoside?

The InChIKey of 4-Nitrophenyl-alpha-D-galactopyranoside is IFBHRQDFSNCLOZ-IIRVCBMXSA-N.

What is the canonical SMILES of 4-Nitrophenyl-alpha-D-galactopyranoside?

The canonical SMILES of 4-Nitrophenyl-alpha-D-galactopyranoside is C1=CC(=CC=C1[N+](=O)[O-])OC2C(C(C(C(O2)CO)O)O)O.

What is the CAS number of 4-Nitrophenyl-alpha-D-galactopyranoside?

The CAS number of 4-Nitrophenyl-alpha-D-galactopyranoside is 7493-95-0.

How many hydrogen bond donor counts does 4-Nitrophenyl-alpha-D-galactopyranoside have?

4-Nitrophenyl-alpha-D-galactopyranoside has 4 hydrogen bond donor counts.

How many hydrogen bond acceptor counts does 4-Nitrophenyl-alpha-D-galactopyranoside have?

4-Nitrophenyl-alpha-D-galactopyranoside has 8 hydrogen bond acceptor counts.

Upstream Synthesis Route 1

  • 17042-39-6
  • 7493-95-0

Reference: [1] Justus Liebigs Annalen der Chemie, 1954, vol. 589, p. 77,79[2] Hoppe-Seyler's Zeitschrift fuer Physiologische Chemie, 1958, vol. 311, p. 54,58
[3] Canadian Journal of Chemistry, 1981, vol. 59, p. 314 - 320

Upstream Synthesis Route 2

  • 25878-60-8
  • 7493-95-0

Reference: [1] Canadian Journal of Chemistry, 1981, vol. 59, p. 314 - 320

Upstream Synthesis Route 3

  • 572-10-1
  • 7493-95-0

Reference: [1] Canadian Journal of Chemistry, 1981, vol. 59, p. 314 - 320

Downstream Synthesis Route 1

  • 1824-94-8
  • 7493-95-0
  • 18449-79-1
  • 81131-45-5

Reference: [1]Carbohydrate Research,1987,vol. 167,p. 95 - 104

Downstream Synthesis Route 2

  • 3396-99-4
  • 7493-95-0
  • 104420-77-1

Reference: [1]Chemical Communications,1999,p. 2065 - 2066
[2]Carbohydrate Research,1987,vol. 167,p. 95 - 104

* For details of the synthesis route, please refer to the original source to ensure accuracy.

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