2694-78-2

2694-78-2 structure
2694-78-2 structure
  • Name: Phenyl[(2H5)phenyl]methanone
  • Chemical Name: (2,3,4,5,6-pentadeuteriophenyl)-phenylmethanone
  • CAS Number: 2694-78-2
  • Molecular Formula: C13H5D5O
  • Molecular Weight: 187.249
  • Catalog: Research Areas Metabolic Disease
  • Create Date: 2018-12-26 18:19:56
  • Modify Date: 2024-01-10 10:16:54
  • Benzophenone-d5 is the deuterium labeled Benzophenone[1]. Benzophenone is an endogenous metabolite.

Name (2,3,4,5,6-pentadeuteriophenyl)-phenylmethanone
Synonyms Phenyl[(H)phenyl]methanone
2,3,4,5,6-pentadeuterio-benzophenone
benzophenone-2,3,4,5,6-d5
Methanone, phenylphenyl-d-
MFCD00084123
benzophenone-d5
2,3,4,5,6-Pentadeuteriobenzophenon
Description Benzophenone-d5 is the deuterium labeled Benzophenone[1]. Benzophenone is an endogenous metabolite.
Related Catalog
In Vitro Stable heavy isotopes of hydrogen, carbon, and other elements have been incorporated into drug molecules, largely as tracers for quantitation during the drug development process. Deuteration has gained attention because of its potential to affect the pharmacokinetic and metabolic profiles of drugs[1].
References

[1]. Russak EM, et al. Impact of Deuterium Substitution on the Pharmacokinetics of Pharmaceuticals. Ann Pharmacother. 2019 Feb;53(2):211-216.  

Density 1.1±0.1 g/cm3
Boiling Point 305.4±0.0 °C at 760 mmHg
Melting Point 47-51ºC(lit.)
Molecular Formula C13H5D5O
Molecular Weight 187.249
Flash Point 123.7±13.7 °C
Exact Mass 187.104553
PSA 17.07000
LogP 3.18
Vapour Pressure 0.0±0.6 mmHg at 25°C
Index of Refraction 1.584
Symbol GHS07
GHS07
Signal Word Warning
Hazard Statements H315-H319-H335
Precautionary Statements P261-P305 + P351 + P338
Hazard Codes Xi
Risk Phrases 36/37/38
Safety Phrases 26-36
RIDADR NONH for all modes of transport

~90%

2694-78-2 structure

2694-78-2

Literature: Yu, Zhoujie; Wang, Wei; Chen, Liqin Journal of Labelled Compounds and Radiopharmaceuticals, 2011 , vol. 54, # 7 p. 352 - 356

~96%

2694-78-2 structure

2694-78-2

Literature: Mo, Fanyang; Trzepkowski, Louis J.; Dong, Guangbin Angewandte Chemie - International Edition, 2012 , vol. 51, # 52 p. 13075 - 13079 Angew. Chem., 2012 , vol. 124, # 52 p. 13252 - 13256,5

~%

2694-78-2 structure

2694-78-2

Literature: Mo, Fanyang; Trzepkowski, Louis J.; Dong, Guangbin Angewandte Chemie - International Edition, 2012 , vol. 51, # 52 p. 13075 - 13079 Angew. Chem., 2012 , vol. 124, # 52 p. 13252 - 13256,5

~%

2694-78-2 structure

2694-78-2

Literature: Mo, Fanyang; Trzepkowski, Louis J.; Dong, Guangbin Angewandte Chemie - International Edition, 2012 , vol. 51, # 52 p. 13075 - 13079 Angew. Chem., 2012 , vol. 124, # 52 p. 13252 - 13256,5