39207-65-3
2-ISOBUTYRYLCYCLOHEXANONE
Name
2-ISOBUTYRYLCYCLOHEXANONE
Formula
C10 H16 O2
MolWeight
168.234
1Identification
【Name】
2-ISOBUTYRYLCYCLOHEXANONE
【CAS】
【MDL】
MFCD00466185
【English Synonyms】
【Formula】
C10 H16 O2
【MolWeight】
168.234
【Inchi】
InChI=1S/C10H16O2/c1-7(2)10(12)8-5-3-4-6-9(8)11/h7-8H,3-6H2,1-2H3
【InChIKey】
InChIKey=PFOYYSGBGILOQZ-UHFFFAOYSA-N
【SMILES】
CC(C)C(=O)C1CCCCC1=O
【MOL File】
2Chemical and Physical Properties
【Computed Properties】
H bond donor:0
H bond acceptor:2
XLogP3:2.0
Bulk/Fine:FB
3Material Safety Data Sheet(MSDS)
【Safety informationSymbol】
【Signal word】
【Hazard statements】
【Precautionary statements】
【hazard symbol】
【Risk Code】
【Safe Code】
【WGK Germany】
3
4CML File
2-ISOBUTYRYLCYCLOHEXANONE.cml
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