Deprecated ChemSpider Record

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ChemSpider 2D Image | benzyl alcohol | C7H8O

benzyl alcohol

  • Molecular FormulaC7H8O
  • Average mass108.138 Da
  • Monoisotopic mass108.057515 Da
  • ChemSpider ID239

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

(hydroxymethyl)benzene
100-51-6 [RN]
202-859-9 [EINECS]
4-06-00-02222 [Beilstein]
a-Hydroxytoluene
a-Toluenol
benzenecarbinol
Benzenemethanol [ACD/Index Name]
benzyl alcohol [INN] [JAN] [JP15] [NF] [USAN] [Wiki]
benzylalcohol
More...

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

HSDB 46 [DBID]
NCI-C06111 [DBID]
Sunmorl BK 20 [DBID]
AI3-01680 [DBID]
BRN 0878307 [DBID]
CCRIS 2081 [DBID]
NSC 8044 [DBID]

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

Density: 1.0±0.0 g/cm3
Boiling Point: 204.7±0.0 °C at 760 mmHg
Vapour Pressure: 0.2±0.0 mmHg at 25°C
Enthalpy of Vaporization: 46.6±0.0 kJ/mol
Flash Point: 97.5±0.0 °C
Index of Refraction: 1.546
Molar Refractivity: 32.7±0.0 cm3
#H bond acceptors: 1
#H bond donors: 1
#Freely Rotating Bonds: 2
#Rule of 5 Violations: 0
ACD/LogP: 1.03
ACD/LogD (pH 5.5): 1.03
ACD/BCF (pH 5.5): 3.60
ACD/KOC (pH 5.5): 87.06
ACD/LogD (pH 7.4): 1.03
ACD/BCF (pH 7.4): 3.60
ACD/KOC (pH 7.4): 87.06
Polar Surface Area: 20 Å2
Polarizability: 13.0±0.0 10-24cm3
Surface Tension: 40.7±0.0 dyne/cm
Molar Volume: 103.2±0.0 cm3

Click to predict properties on the Chemicalize site






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