85850-85-7
3-(ALLYLOXY)-10-ETHYL-11-(4-HYDROXYPHENYL)DIBENZO(B,F)OXEPIN
Name3-(ALLYLOXY)-10-ETHYL-11-(4-HYDROXYPHENYL)DIBENZO(B,F)OXEPIN
1Identification
【Name】
3-(ALLYLOXY)-10-ETHYL-11-(4-HYDROXYPHENYL)DIBENZO(B,F)OXEPIN
【CAS】
【MDL】
MFCD01707855
【English Synonyms】
【Formula】
C25 H22 O3
【MolWeight】
370.446
【Inchi】
InChI=1S/C25H22O3/c1-3-15-27-19-13-14-22-24(16-19)28-23-8-6-5-7-21(23)20(4-2)25(22)17-9-11-18(26)12-10-17/h3,5-14,16,26H,1,4,15H2,2H3
【InChIKey】
InChIKey=UOXXUALEFWGXFB-UHFFFAOYSA-N
【SMILES】
CCC1=C(c2ccc(cc2Oc3c1cccc3)OCC=C)c4ccc(cc4)O
【MOL File】
3-(ALLYLOXY)-10-ETHY….mol
2Chemical and Physical Properties
【Computed Properties】
H bond donor:1
H bond acceptor:3
XLogP3:8.0
Bulk/Fine:F
3Material Safety Data Sheet(MSDS)
4CML File
3-(ALLYLOXY)-10-ETHYL-11-(4-HYDROXYPHENYL)DIBENZO(B,F)OXEPIN.cml