595581-64-9
(-)-(3AR,6AR)-TETRAHYDRO-2,2-DIMETHYL-4H-CYCLOPENTA-1,3-DIOXOL-4-ONE
Name(-)-(3AR,6AR)-TETRAHYDRO-2,2-DIMETHYL-4H-CYCLOPENTA-1,3-DIOXOL-4-ONE
1Identification
【Name】
(-)-(3AR,6AR)-TETRAHYDRO-2,2-DIMETHYL-4H-CYCLOPENTA-1,3-DIOXOL-4-ONE
【CAS】
【MDL】
MFCD08166677
【English Synonyms】
【Formula】
C8 H12 O3
【MolWeight】
156.18
【Inchi】
InChI=1S/C8H12O3/c1-8(2)10-6-4-3-5(9)7(6)11-8/h6-7H,3-4H2,1-2H3/t6-,7+/m1/s1
【InChIKey】
InChIKey=NVWKQINXZFLZPL-RQJHMYQMSA-N
【SMILES】
CC1(O[C@@H]2CCC(=O)[C@@H]2O1)C
【MOL File】
(-)-(3AR,6AR)-TETRAH….mol
2Chemical and Physical Properties
【Computed Properties】
H bond donor:0
H bond acceptor:3
XLogP3:1.0
Bulk/Fine:F
3Material Safety Data Sheet(MSDS)
4CML File
(-)-(3AR,6AR)-TETRAHYDRO-2,2-DIMETHYL-4H-CYCLOPENTA-1,3-DIOXOL-4-ONE.cml