56327-04-9
1,4-DIOXASPIRO[4.5]DECANE-8-CARBOXYLIC ACID, 8-(4-METHOXYPHENYL)
Name1,4-DIOXASPIRO[4.5]DECANE-8-CARBOXYLIC ACID, 8-(4-METHOXYPHENYL)
1Identification
【Name】
1,4-DIOXASPIRO[4.5]DECANE-8-CARBOXYLIC ACID, 8-(4-METHOXYPHENYL)
【CAS】
【MDL】
MFCD20265461
【English Synonyms】
【Formula】
C16 H20 O5
【MolWeight】
292.329
【Inchi】
InChI=1S/C16H20O5/c1-19-13-4-2-12(3-5-13)15(14(17)18)6-8-16(9-7-15)20-10-11-21-16/h2-5H,6-11H2,1H3,(H,17,18)
【InChIKey】
InChIKey=KGVYVZCZKIDIBH-UHFFFAOYSA-N
【SMILES】
COc1ccc(cc1)C2(CCC3(CC2)OCCO3)C(=O)O
【MOL File】
1,4-DIOXASPIRO[4.5]D….mol
2Chemical and Physical Properties
【Computed Properties】
H bond donor:1
H bond acceptor:5
XLogP3:3.0
Bulk/Fine:F
3Material Safety Data Sheet(MSDS)
4CML File
1,4-DIOXASPIRO[4.5]DECANE-8-CARBOXYLIC ACID, 8-(4-METHOXYPHENYL).cml