1226-42-2

1226-42-2 structure
1226-42-2 structure

Name 4,4'-Dimethoxybenzil
Synonyms 4,4′-Dimethoxybenzil
MFCD00008405
EINECS 214-960-5
4,4‘-Dimethoxybenzil
1,2-bis(4-methoxyphenyl)ethane-1,2-dione
Description 4,4'-Dimethoxybenzil is a human intestinal carboxyl esterase (hiCE) inhibitor with Ki of 70 nM.
Related Catalog
Target

Ki: 70 nM (hiCE)[1]

In Vitro By reducing irinotecaninduced diarrhea, hiCE inhibitors (e.g., 4,4'-Dimethoxybenzil, Compound 8) can improve the anti-cancer efficacy of irinotecan. To find effective hiCE inhibitors, a new virtual screening protocol that combines pharmacophore models derived from the hiCE structure and its ligands has been proposed[1].
References

[1]. GuoDong Zhang, et al. Predicting hiCE inhibitors based upon pharmacophore models derived from the receptor and its ligands. Science China Chemistry

Density 1.183g/cm3
Boiling Point 442.2ºC at 760 mmHg
Melting Point 132-134ºC(lit.)
Molecular Formula C16H14O4
Molecular Weight 270.28000
Flash Point 197.5ºC
Exact Mass 270.08900
PSA 52.60000
LogP 2.76940
Vapour Pressure 5.13E-08mmHg at 25°C
Index of Refraction 1.566
Personal Protective Equipment Eyeshields;Gloves;type N95 (US);type P1 (EN143) respirator filter
Hazard Codes Xi
Risk Phrases R36/37/38
Safety Phrases 22-24/25-36/37-26
RIDADR NONH for all modes of transport
WGK Germany 3
HS Code 2914509090
HS Code 2914509090
Summary HS:2914509090 other ketones with other oxygen function VAT:17.0% Tax rebate rate:9.0% Supervision conditions:none MFN tariff:5.5% General tariff:30.0%