898756-66-6
3,4-DIFLUORO-2'-[8-(1,4-DIOXA-8-AZASPIRO[4.5]DECYL)METHYL]BENZOPHENONE
Name3,4-DIFLUORO-2'-[8-(1,4-DIOXA-8-AZASPIRO[4.5]DECYL)METHYL]BENZOPHENONE
1Identification
【Name】
3,4-DIFLUORO-2'-[8-(1,4-DIOXA-8-AZASPIRO[4.5]DECYL)METHYL]BENZOPHENONE
【CAS】
【MDL】
MFCD03842731
【English Synonyms】
【Formula】
C21 H21 F2 N O3
【MolWeight】
373.397
【Inchi】
InChI=1S/C21H21F2NO3/c22-18-6-5-15(13-19(18)23)20(25)17-4-2-1-3-16(17)14-24-9-7-21(8-10-24)26-11-12-27-21/h1-6,13H,7-12,14H2
【InChIKey】
InChIKey=MLWJGDMNUGWWIY-UHFFFAOYSA-N
【SMILES】
c1ccc(c(c1)CN2CCC3(CC2)OCCO3)C(=O)c4ccc(c(c4)F)F
【MOL File】
3,4-DIFLUORO-2'-[8-(….mol
2Chemical and Physical Properties
【Computed Properties】
H bond donor:0
H bond acceptor:4
XLogP3:4.0
Bulk/Fine:F
3Material Safety Data Sheet(MSDS)
4CML File
3,4-DIFLUORO-2'-[8-(1,4-DIOXA-8-AZASPIRO[4.5]DECYL)METHYL]BENZOPHENONE.cml