571-63-1
5-METHYL-1,4-DIHYDRONAPHTHALENE-1,4-DIONE
Name5-METHYL-1,4-DIHYDRONAPHTHALENE-1,4-DIONE
1Identification
【Name】
5-METHYL-1,4-DIHYDRONAPHTHALENE-1,4-DIONE
【CAS】
【MDL】
MFCD08456798
【English Synonyms】
【Formula】
C11 H8 O2
【MolWeight】
172.182
【Inchi】
InChI=1S/C11H8O2/c1-7-3-2-4-8-9(12)5-6-10(13)11(7)8/h2-6H,1H3
【InChIKey】
InChIKey=HVEQLLXOVCUBPR-UHFFFAOYSA-N
【SMILES】
Cc1cccc2c1C(=O)C=CC2=O
【MOL File】
5-METHYL-1,4-DIHYDRO….mol
2Chemical and Physical Properties
【Computed Properties】
H bond donor:0
H bond acceptor:2
XLogP3:2.0
Bulk/Fine:F
3Material Safety Data Sheet(MSDS)
4CML File
5-METHYL-1,4-DIHYDRONAPHTHALENE-1,4-DIONE.cml