5-O-Methylembelin

2-hydroxy-5-methoxy-3-undecylcyclohexa-2,5-diene-1,4-dione

Also Known As: 5-O-Methylembelin|5-O-methyl embelin|2-Hydroxy-5-methoxy-3-undecyl-1,4-benzoquinone|2-hydroxy-5-methoxy-3-undecylcyclohexa-2,5-diene-1,4-dione|2-Hydroxy-5-methoxy-3-undecyl-[1,4]benzoquinone|2-hydroxy-5-methoxy-3-undecyl[1,4]benzoquinone|HY-W510159|ALPHA-ACETAMIDO-2-METHYLCINNAMICACID|2-Hydroxy-3-undecyl-5-methoxy-1,4-benzoquinone|2,5-Cyclohexadiene-1,4-dione, 2-hydroxy-5-methoxy-3-undecyl-|AM-573/21176004|2,5-Cyclohexadiene-1,4-dione,2-hydroxy-5-methoxy-3-undecyl-|2-Hydroxy-3-undecyl-5-methoxy-2,5-cyclohexadiene-1,4-dione|2-Hydroxy-5-methoxy-3-undecyl-2,5-cyclohexadiene-1,4-dione|5-METHOXY-2-OXIDANYL-3-UNDECYL-CYCLOHEXA-2,5-DIENE-1,4-DIONE

Molecular Formula	C18H28O4
Molecular Weight	308.19876 g/mol
LogP	5.7
Topological Polar Surface Area	63.6 Ų
Hydrogen Bond Donors	1
Hydrogen Bond Acceptors	4
Rotatable Bonds	11
Exact Mass	308.19876
Monoisotopic Mass	308.19876
Heavy Atoms	22
Complexity	446.0
Melting Point	95 - 96 °C

Chemical Identifiers

CAS Number	56005-10-8
SMILES	CCCCCCCCCCCC1=C(C(=O)C=C(C1=O)OC)O
InChIKey	KHBJLRRAMCJZLZ-UHFFFAOYSA-N