887679-08-5
3-[(3,5-DIMETHYLISOXAZOL-4-YL)METHYL]-4-METHOXYBENZALDEHYDE
Name3-[(3,5-DIMETHYLISOXAZOL-4-YL)METHYL]-4-METHOXYBENZALDEHYDE
1Identification
【Name】
3-[(3,5-DIMETHYLISOXAZOL-4-YL)METHYL]-4-METHOXYBENZALDEHYDE
【CAS】
【MDL】
MFCD06801637
【中文同义词】
【EnglishSynonyms】
【pro_formula】
C14 H15 N O3
【pro_molWeight】
245.277
【Inchi】
InChI=1S/C14H15NO3/c1-9-13(10(2)18-15-9)7-12-6-11(8-16)4-5-14(12)17-3/h4-6,8H,7H2,1-3H3
【InChIKey】
InChIKey=KYMFDJYFADPPKK-UHFFFAOYSA-N
【SMILES】
Cc1c(c(on1)C)Cc2cc(ccc2OC)C=O
【MOL File】
3-[(3,5-DIMETHYLISOX….mol
2ChemicalProperties
【ComputedProperties】
pro_donors:0
pro_acceptors:4
XLogP3:3.0
Bulk/Fine:F
3MaterialMSDS
4CMLFile
3-[(3,5-DIMETHYLISOXAZOL-4-YL)METHYL]-4-METHOXYBENZALDEHYDE.cml