55604-88-1
1-OXO-4-HYDROXY-2-EN-4-ETHYLCYCLOHEXA-5,8-OLIDE
Name
1-OXO-4-HYDROXY-2-EN-4-ETHYLCYCLOHEXA-5,8-OLIDE
Formula
C8 H8 O4
MolWeight
168.147
1Identification
【Name】
1-OXO-4-HYDROXY-2-EN-4-ETHYLCYCLOHEXA-5,8-OLIDE
【CAS】
【MDL】
MFCD18451230
【English Synonyms】
【Formula】
C8 H8 O4
【MolWeight】
168.147
【Inchi】
InChI=1S/C8H8O4/c9-5-1-2-8(11)4-7(10)12-6(8)3-5/h1-2,6,11H,3-4H2
【InChIKey】
InChIKey=USTIRZSUTZHBAK-UHFFFAOYSA-N
【SMILES】
C1C2C(CC(=O)O2)(C=CC1=O)O
【MOL File】
2Chemical and Physical Properties
【Computed Properties】
H bond donor:1
H bond acceptor:4
XLogP3:-1.0
Bulk/Fine:F
3Material Safety Data Sheet(MSDS)
4CML File
1-OXO-4-HYDROXY-2-EN-4-ETHYLCYCLOHEXA-5,8-OLIDE.cml
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