56805-07-3
7,7-DIMETHYL-1,4,5,6-TETRAPHENYL-7-SILABICYCLO[2.2.1]HEPT-5-ENE-2-CARBOXYLIC ACID ETHYL ESTER
Name7,7-DIMETHYL-1,4,5,6-TETRAPHENYL-7-SILABICYCLO[2.2.1]HEPT-5-ENE-2-CARBOXYLIC ACID ETHYL ESTER
1Identification
【Name】
7,7-DIMETHYL-1,4,5,6-TETRAPHENYL-7-SILABICYCLO[2.2.1]HEPT-5-ENE-2-CARBOXYLIC ACID ETHYL ESTER
【CAS】
【MDL】
MFCD21609026
【English Synonyms】
【Formula】
C35 H34 O2 Si
【MolWeight】
514.738
【Inchi】
InChI=1S/C35H34O2Si/c1-4-37-33(36)30-25-34(28-21-13-7-14-22-28)31(26-17-9-5-10-18-26)32(27-19-11-6-12-20-27)35(30,38(34,2)3)29-23-15-8-16-24-29/h5-24,30H,4,25H2,1-3H3/t30?,34-,35-/m1/s1
【InChIKey】
InChIKey=UANXSIZFKKUVNR-JXVZUCHFSA-N
【SMILES】
CCOC(=O)C1C[C@]2(C(=C([C@@]1([Si]2(C)C)c3ccccc3)c4ccccc4)c5ccccc5)c6ccccc6
【MOL File】
7,7-DIMETHYL-1,4,5,6….mol
2Chemical and Physical Properties
【Computed Properties】
H bond donor:0
H bond acceptor:2
XLogP3:10.0
Bulk/Fine:F
3Material Safety Data Sheet(MSDS)
4CML File
7,7-DIMETHYL-1,4,5,6-TETRAPHENYL-7-SILABICYCLO[2.2.1]HEPT-5-ENE-2-CARBOXYLIC ACID ETHYL ESTER.cml