898781-20-9
CYCLOHEXYL 2-[8-(1,4-DIOXA-8-AZASPIRO[4.5]DECYL)METHYL]PHENYL KETONE
NameCYCLOHEXYL 2-[8-(1,4-DIOXA-8-AZASPIRO[4.5]DECYL)METHYL]PHENYL KETONE
1Identification
【Name】
CYCLOHEXYL 2-[8-(1,4-DIOXA-8-AZASPIRO[4.5]DECYL)METHYL]PHENYL KETONE
【CAS】
【MDL】
MFCD03842737
【中文同义词】
【EnglishSynonyms】
【pro_formula】
C21 H29 N O3
【pro_molWeight】
343.464
【Inchi】
InChI=1S/C21H29NO3/c23-20(17-6-2-1-3-7-17)19-9-5-4-8-18(19)16-22-12-10-21(11-13-22)24-14-15-25-21/h4-5,8-9,17H,1-3,6-7,10-16H2
【InChIKey】
InChIKey=YVEBVPQFCZONAL-UHFFFAOYSA-N
【SMILES】
c1ccc(c(c1)CN2CCC3(CC2)OCCO3)C(=O)C4CCCCC4
【MOL File】
CYCLOHEXYL 2-[8-(1,4….mol
2ChemicalProperties
【ComputedProperties】
pro_donors:0
pro_acceptors:4
XLogP3:4.0
Bulk/Fine:F
3MaterialMSDS
4CMLFile
CYCLOHEXYL 2-[8-(1,4-DIOXA-8-AZASPIRO[4.5]DECYL)METHYL]PHENYL KETONE.cml