54125-08-5
1-METHYL-4-OXOCYCLOHEX-2-ENE-1-CARBALDEHYDE
Name1-METHYL-4-OXOCYCLOHEX-2-ENE-1-CARBALDEHYDE
1Identification
【Name】
1-METHYL-4-OXOCYCLOHEX-2-ENE-1-CARBALDEHYDE
【CAS】
【MDL】
MFCD19300844
【English Synonyms】
【Formula】
C8 H10 O2
【MolWeight】
138.165
【Inchi】
InChI=1S/C8H10O2/c1-8(6-9)4-2-7(10)3-5-8/h2,4,6H,3,5H2,1H3
【InChIKey】
InChIKey=PWHTXZHPTJWQDO-UHFFFAOYSA-N
【SMILES】
CC1(CCC(=O)C=C1)C=O
【MOL File】
1-METHYL-4-OXOCYCLOH….mol
2Chemical and Physical Properties
【Computed Properties】
H bond donor:0
H bond acceptor:2
XLogP3:0.0
Bulk/Fine:F
3Material Safety Data Sheet(MSDS)
4CML File
1-METHYL-4-OXOCYCLOHEX-2-ENE-1-CARBALDEHYDE.cml