CAS No. 103890-78-4

 

Product Information

Chemical Formula: C26H33NO6
Molecular Weight:455.54
Synonyms:3,5-pyridinedicarboxylicacid,1,4-dihydro-2,6-dimethyl-4-(2-(3-(1,1-dimethylet; diethylester,(e)-hoxy)-3-oxo-1-propenyl)phenyl); MOTENS; GX-1048; GR-43659X; CALDINE; (E)-4-[2-[3-(1,1-DIMETHYLETHOXY)-3-OXO-1-PROPENYL]PHENYL]-1,4-DIHYDRO-2,6-DIMETHYL-3,5-PYRIDINEDICARBOXYLIC ACID DIETHYL ESTER; LACIPIL
MDL No.:MFCD00865936
EINECS / EC No.:1312995-182-4
Pubchem CID:5311217
IUPAC Name:diethyl 2,6-dimethyl-4-[2-[(E)-3-[(2-methylpropan-2-yl)oxy]-3-oxoprop-1-enyl]phenyl]-1,4-dihydropyridine-3,5-dicarboxylate
Standard InchI:InChI=1S/C26H33NO6/c1-8-31-24(29)21-16(3)27-17(4)22(25(30)32-9-2)23(21)19-13-11-10-12-18(19)14-15-20(28)33-26(5,6)7/h10-15,23,27H,8-9H2,1-7H3/b15-14+
InchI Key:GKQPCPXONLDCMU-CCEZHUSRSA-N
SMILES:CCOC(=O)C1=C(NC(=C(C1C2=CC=CC=C2C=CC(=O)OC(C)(C)C)C(=O)OCC)C)C
Appearance:white to beige
Melting Point:174-175 °C
Boiling Point:558.4 °C at 760 mmHg
Density (Theoretical):1.127 g/cm3
Solubility:DMSO: soluble20mg/mL, clear
Refractive Index:1.54

Safety Information

Signal Word: Warning
Hazard Statements:H302
Precautionary Statements:P280-P305+P351+P338
Flash Point:291.5 °C
Transportation Information:N/A
GHS Pictograms:Exclamation Mark - GHS07