898758-10-6
4'-[8-(1,4-DIOXA-8-AZASPIRO[4.5]DECYL)METHYL]-2-TRIFLUOROMETHYLBENZOPHENONE
Name
4'-[8-(1,4-DIOXA-8-AZASPIRO[4.5]DECYL)METHYL]-2-TRIFLUOROMETHYLBENZOPHENONE
Formula
C22 H22 F3 N O3
MolWeight
405.414
1Identification
【Name】
4'-[8-(1,4-DIOXA-8-AZASPIRO[4.5]DECYL)METHYL]-2-TRIFLUOROMETHYLBENZOPHENONE
【CAS】
【MDL】
MFCD03841697
【English Synonyms】
【Formula】
C22 H22 F3 N O3
【MolWeight】
405.414
【Inchi】
InChI=1S/C22H22F3NO3/c23-22(24,25)19-4-2-1-3-18(19)20(27)17-7-5-16(6-8-17)15-26-11-9-21(10-12-26)28-13-14-29-21/h1-8H,9-15H2
【InChIKey】
InChIKey=ZPMHLFTWQZINBP-UHFFFAOYSA-N
【SMILES】
c1ccc(c(c1)C(=O)c2ccc(cc2)CN3CCC4(CC3)OCCO4)C(F)(F)F
【MOL File】
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
4'-[8-(1,4-DIOXA-8-AZASPIRO[4.5]DECYL)METHYL]-2-TRIFLUOROMETHYLBENZOPHENONE.cml
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