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 | benzotrichloride | C7H5Cl3

benzotrichloride

  • Molecular FormulaC7H5Cl3
  • Average mass195.474 Da
  • Monoisotopic mass193.945683 Da
  • ChemSpider ID7089

More details:

Date of deprecation: 13:33, Feb 22, 2024
Reason for deprecation: Deprecate record: Testing Bad record 2

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

(Trichloromethyl)benzene [ACD/IUPAC Name]
1-(trichloromethyl)benzene
202-634-5 [EINECS]
4-05-00-00820 [Beilstein]
98-07-7 [RN]
a,a,a-Trichlorotoluene
Benzene, (trichloromethyl)- [ACD/Index Name]
Benzene, trichloromethyl-
benzenyl trichloride
benzotrichloride [Wiki]
More...

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

HSDB 2076 [DBID]
UN 2226 [DBID]
AI3-02583 [DBID]
BRN 0508152 [DBID]
CCRIS 1292 [DBID]
NSC 14663 [DBID]

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

Density: 1.4±0.0 g/cm3
Boiling Point: 213.5±0.0 °C at 760 mmHg
Vapour Pressure: 0.2±0.0 mmHg at 25°C
Enthalpy of Vaporization: 43.2±0.0 kJ/mol
Flash Point: 133.2±0.0 °C
Index of Refraction: 1.556
Molar Refractivity: 45.3±0.0 cm3
#H bond acceptors: 0
#H bond donors: 0
#Freely Rotating Bonds: 0
#Rule of 5 Violations: 0
ACD/LogP: 3.34
ACD/LogD (pH 5.5): 3.34
ACD/BCF (pH 5.5): 204.60
ACD/KOC (pH 5.5): 1569.48
ACD/LogD (pH 7.4): 3.34
ACD/BCF (pH 7.4): 204.60
ACD/KOC (pH 7.4): 1569.48
Polar Surface Area: 0 Å2
Polarizability: 18.0±0.0 10-24cm3
Surface Tension: 38.7±0.0 dyne/cm
Molar Volume: 140.7±0.0 cm3

Click to predict properties on the Chemicalize site


Advertisement