92730-85-3
2-ETHYL-4-METHYL-6-OXO-4-CYCLOHEXENE-1,3-DICARBOXYLIC ACID 1,3-DIETHYL ESTER
Name2-ETHYL-4-METHYL-6-OXO-4-CYCLOHEXENE-1,3-DICARBOXYLIC ACID 1,3-DIETHYL ESTER
1Identification
【Name】
2-ETHYL-4-METHYL-6-OXO-4-CYCLOHEXENE-1,3-DICARBOXYLIC ACID 1,3-DIETHYL ESTER
【CAS】
【MDL】
MFCD17215545
【English Synonyms】
【Formula】
C15 H22 O5
【MolWeight】
282.334
【Inchi】
InChI=1S/C15H22O5/c1-5-10-12(14(17)19-6-2)9(4)8-11(16)13(10)15(18)20-7-3/h8,10,12-13H,5-7H2,1-4H3
【InChIKey】
InChIKey=TXNVNFOEXPUCCB-UHFFFAOYSA-N
【SMILES】
CCC1C(C(=CC(=O)C1C(=O)OCC)C)C(=O)OCC
【MOL File】
2-ETHYL-4-METHYL-6-O….mol
2Chemical and Physical Properties
【Computed Properties】
H bond donor:0
H bond acceptor:5
XLogP3:2.0
Bulk/Fine:F
3Material Safety Data Sheet(MSDS)
4CML File
2-ETHYL-4-METHYL-6-OXO-4-CYCLOHEXENE-1,3-DICARBOXYLIC ACID 1,3-DIETHYL ESTER.cml