Name | bucetin |
Synonyms | bucetin betadid 3-hydroxy-p-butyrophenetidid 3-hydroxybutyr-4-phenetidide 3-HYDROXY-P-BUTYROPHENETIDINE 3-Hydroxy-p-butyrophenetidine 4'-ethoxy-3-hydroxy-butyranilid beta-oxybuttersaeure-p-phenetidid N-(3-HYDROXYBUTYRYL)-P-PHENETIDINE beta-hydroxybutyricacid-p-phenetidide N-(4-ethoxyphenyl)-3-hydroxybutanamide N-(4-ETHOXYPHENYL)-3-HYDROXYBUTANAMIDE Bucetin (3-Hydroxy-p-butyrophenetidide) |
CAS | 1083-57-4 |
EINECS | 214-109-8 |
InChI | InChI=1/C12H17NO3/c1-3-16-11-6-4-10(5-7-11)13-12(15)8-9(2)14/h4-7,9,14H,3,8H2,1-2H3,(H,13,15) |
Molecular Formula | C12H17NO3 |
Molar Mass | 223.27 |
Density | 1.1223 (rough estimate) |
Melting Point | 160 °C |
Boling Point | 364.56°C (rough estimate) |
Flash Point | 216°C |
Solubility | DMSO (Slightly), Methanol (Slightly, Heated, Sonicated) |
Vapor Presure | 2.77E-08mmHg at 25°C |
Appearance | neat |
Color | White to Off-White |
Merck | 14,1458 |
pKa | 14.07±0.70(Predicted) |
Storage Condition | Sealed in dry,Room Temperature |
Refractive Index | 1.5300 (estimate) |
MDL | MFCD00021906 |
Hazard Symbols | T - Toxic |
Risk Codes | R45 - May cause cancer R46 - May cause heritable genetic damage R20/21/22 - Harmful by inhalation, in contact with skin and if swallowed. |
Safety Description | S53 - Avoid exposure - obtain special instructions before use. S22 - Do not breathe dust. S36/37/39 - Wear suitable protective clothing, gloves and eye/face protection. S45 - In case of accident or if you feel unwell, seek medical advice immediately (show the label whenever possible.) |
WGK Germany | 3 |
RTECS | EU0900000 |
Toxicity | LD50 in mice (mg/kg): 790 i.p., 2800 orally (Fujimura) |
1mg | 5mg | 10mg | |
---|---|---|---|
1 mM | 4.479 ml | 22.394 ml | 44.789 ml |
5 mM | 0.896 ml | 4.479 ml | 8.958 ml |
10 mM | 0.448 ml | 2.239 ml | 4.479 ml |
5 mM | 0.09 ml | 0.448 ml | 0.896 ml |