77851-07-1
2-CYCLOHEXENE-1-CARBOXYLIC ACID, 2,3,6,6-TETRAMETHYL ETHYL ESTER
Name2-CYCLOHEXENE-1-CARBOXYLIC ACID, 2,3,6,6-TETRAMETHYL ETHYL ESTER
1Identification
【Name】
2-CYCLOHEXENE-1-CARBOXYLIC ACID, 2,3,6,6-TETRAMETHYL ETHYL ESTER
【CAS】
【MDL】
MFCD12031478
【English Synonyms】
【Formula】
C13 H22 O2
【MolWeight】
210.315
【Inchi】
InChI=1S/C13H22O2/c1-6-15-12(14)11-10(3)9(2)7-8-13(11,4)5/h11H,6-8H2,1-5H3
【InChIKey】
InChIKey=GUAPMIRFNRZYFI-UHFFFAOYSA-N
【SMILES】
CCOC(=O)C1C(=C(CCC1(C)C)C)C
【MOL File】
2-CYCLOHEXENE-1-CARB….mol
2Chemical and Physical Properties
【Computed Properties】
H bond donor:0
H bond acceptor:2
XLogP3:4.0
Bulk/Fine:F
3Material Safety Data Sheet(MSDS)
4CML File
2-CYCLOHEXENE-1-CARBOXYLIC ACID, 2,3,6,6-TETRAMETHYL ETHYL ESTER.cml