54757-47-0
4-(4-METHOXY-2,3,6-TRIMETHYLPHENYL)-BUT-3-EN-2-ONE
Name
4-(4-METHOXY-2,3,6-TRIMETHYLPHENYL)-BUT-3-EN-2-ONE
Formula
C14 H18 O2
MolWeight
218.294
1Identification
【Name】
4-(4-METHOXY-2,3,6-TRIMETHYLPHENYL)-BUT-3-EN-2-ONE
【CAS】
54757-47-0
;62924-31-6
【MDL】
MFCD00449197
【English Synonyms】
【Formula】
C14 H18 O2
【MolWeight】
218.294
【Inchi】
InChI=1S/C14H18O2/c1-9-8-14(16-5)12(4)11(3)13(9)7-6-10(2)15/h6-8H,1-5H3/b7-6+
【InChIKey】
InChIKey=NMRRLIHKRCVLLQ-VOTSOKGWSA-N
【SMILES】
Cc1cc(c(c(c1/C=C/C(=O)C)C)C)OC
【MOL File】
2Chemical and Physical Properties
【Computed Properties】
H bond donor:0
H bond acceptor:2
XLogP3:3.0
Bulk/Fine:FB
3Material Safety Data Sheet(MSDS)
4CML File
4-(4-METHOXY-2,3,6-TRIMETHYLPHENYL)-BUT-3-EN-2-ONE.cml
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Catalog No:54757-47-0 up to kgs
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