866604-88-8
4,5-DIHYDRO-3-(4-HYDROXYPHENYL)-4-PROPYL-5-ISOXAZOLEACETIC ACID
Name4,5-DIHYDRO-3-(4-HYDROXYPHENYL)-4-PROPYL-5-ISOXAZOLEACETIC ACID
1Identification
【Name】
4,5-DIHYDRO-3-(4-HYDROXYPHENYL)-4-PROPYL-5-ISOXAZOLEACETIC ACID
【CAS】
【MDL】
MFCD16878612
【中文同义词】
【EnglishSynonyms】
【pro_formula】
C14 H17 N O4
【pro_molWeight】
263.291
【Inchi】
InChI=1S/C14H17NO4/c1-2-3-11-12(8-13(17)18)19-15-14(11)9-4-6-10(16)7-5-9/h4-7,11-12,16H,2-3,8H2,1H3,(H,17,18)
【InChIKey】
InChIKey=IDZBJRKBVZULNK-UHFFFAOYSA-N
【SMILES】
CCCC1C(ON=C1c2ccc(cc2)O)CC(=O)O
【MOL File】
4,5-DIHYDRO-3-(4-HYD….mol
2ChemicalProperties
【ComputedProperties】
pro_donors:2
pro_acceptors:5
XLogP3:2.0
Bulk/Fine:F
3MaterialMSDS
4CMLFile
4,5-DIHYDRO-3-(4-HYDROXYPHENYL)-4-PROPYL-5-ISOXAZOLEACETIC ACID.cml