79989-25-6
5H-DIBENZ(D,F)AZONIN-1-OL, 6,7,8,9-TETRAHYDRO-2,12-DIMETHOXY-7-METHYL-6-(PHENYLMETHYL)-, ACETATE (ESTER), (-)-
Name5H-DIBENZ(D,F)AZONIN-1-OL, 6,7,8,9-TETRAHYDRO-2,12-DIMETHOXY-7-METHYL-6-(PHENYLMETHYL)-, ACETATE (ESTER), (-)-
1Identification
【Name】
5H-DIBENZ(D,F)AZONIN-1-OL, 6,7,8,9-TETRAHYDRO-2,12-DIMETHOXY-7-METHYL-6-(PHENYLMETHYL)-, ACETATE (ESTER), (-)-
【CAS】
【MDL】
MFCD01752442
【English Synonyms】
【Formula】
C28 H31 N O4
【MolWeight】
445.556
【Inchi】
InChI=1S/C28H31NO4/c1-19(30)33-28-26(32-4)13-11-22-17-23(16-20-8-6-5-7-9-20)29(2)15-14-21-10-12-24(31-3)18-25(21)27(22)28/h5-13,18,23H,14-17H2,1-4H3
【InChIKey】
InChIKey=RJMYPURSBZLXKN-UHFFFAOYSA-N
【SMILES】
CC(=O)Oc1c(ccc2c1-c3cc(ccc3CCN(C(C2)Cc4ccccc4)C)OC)OC
【MOL File】
5H-DIBENZ(D,F)AZONIN….mol
2Chemical and Physical Properties
【Computed Properties】
H bond donor:0
H bond acceptor:5
XLogP3:0.0
Bulk/Fine:F
3Material Safety Data Sheet(MSDS)
4CML File
5H-DIBENZ(D,F)AZONIN-1-OL, 6,7,8,9-TETRAHYDRO-2,12-DIMETHOXY-7-METHYL-6-(PHENYLMETHYL)-, ACETATE (ESTER), (-)-.cml