Deprecated ChemSpider Record

You have reached the page for a ChemSpider record that has been deprecated.

This page is not active and is only accessible by directly using this URL. If you have been directed here from another website or database please notify the administrator of that resource. See below for more details.

ChemSpider 2D Image | 2-Hydroxybutyl 2,3,6-tris-O-(2-hydroxybutyl)-4-O-[2,3,4,6-tetrakis-O-(2-hydroxybutyl)hexopyranosyl]hexopyranoside - methyl 2,3,6-tri-O-methyl-4-O-(2,3,4,6-tetra-O-methylhexopyranosyl)hexopyranoside (1 :1) | C64H124O30

2-Hydroxybutyl 2,3,6-tris-O-(2-hydroxybutyl)-4-O-[2,3,4,6-tetrakis-O-(2-hydroxybutyl)hexopyranosyl]hexopyranoside - methyl 2,3,6-tri-O-methyl-4-O-(2,3,4,6-tetra-O-methylhexopyranosyl)hexopyranoside (1 :1)

  • Molecular FormulaC64H124O30
  • Average mass1373.651 Da
  • Monoisotopic mass1372.817749 Da
  • ChemSpider ID2341170

More details:

Date of deprecation: 15:11, Jan 10, 2014
Reason for deprecation: Deprecate record: attempt to provide a structure for a bio-oligomer(cellulose) without well defined structure

If you believe this record was deprecated in error, please use the Comment on this record button to contact the ChemSpider team.

Common reasons for deprecation are:
  • Chemically impossible structures (eg. incorrect valence atoms)
  • Lack of any linking data sources
  • Poor depiction of a structure that is already in ChemSpider

Validated by Experts, Validated by Users, Non-Validated, Removed by Users

9041-56-9 [RN]
9083-50-5 [RN]
Cellulose, hydroxybutyl methyl ether
Hydroxybutyl methyl cellulose
Hydroxybutyl methylcellulose

Predicted data is generated using the ACD/Labs Percepta Platform - PhysChem Module, version: 14.00

Density:
Boiling Point: 944.4±0.0 °C at 760 mmHg
Vapour Pressure: 0.0±0.0 mmHg at 25°C
Enthalpy of Vaporization: 155.9±0.0 kJ/mol
Flash Point: 525.0±0.0 °C
Index of Refraction:
Molar Refractivity:
#H bond acceptors: 19
#H bond donors: 8
#Freely Rotating Bonds: 44
#Rule of 5 Violations: 3
ACD/LogP: 3.01
ACD/LogD (pH 5.5): 3.01
ACD/BCF (pH 5.5): 114.79
ACD/KOC (pH 5.5): 1037.08
ACD/LogD (pH 7.4): 3.01
ACD/BCF (pH 7.4): 114.79
ACD/KOC (pH 7.4): 1037.08
Polar Surface Area: 175 Å2
Polarizability:
Surface Tension:
Molar Volume:

Click to predict properties on the Chemicalize site


Advertisement