6-(4-methoxy-3,5-dimethylphenyl)-6-oxohexanoic acid

6-(4-methoxy-3,5-dimethylphenyl)-6-oxohexanoic acid

CAS: 122004-99-3

Formula: C15H20O4

SMILES: COC1=C(C)C=C(C=C1C)C(=O)CCCCC(O)=O

IUPAC: 6-(4-methoxy-3,5-dimethylphenyl)-6-oxohexanoic acid

InChI: InChI=1S/C15H20O4/c1-10-8-12(9-11(2)15(10)19-3)13(16)6-4-5-7-14(17)18/h8-9H,4-7H2,1-3H3,(H,17,18)

Composition: C (68.16%), H (7.63%), O (24.21%)

Molar Mass: 264.321

Atom Count: 39

Heavy Atom Count: 19

Properties

Properties

Common Names	N/A
Aromatic Ring Count	1
Asymmetric Atom Count	0
Exact Mass	264.136159124
Formal Charge	0
FSP3	0.47
Hetero Ring Count	0
Hydrogen Bond Acceptor Count	4
Hydrogen Bond Donor Count	1
InChIKey	HHVBXODSXYCXGI-UHFFFAOYSA-N
Lipinski's Rule of Five	1
Molar Refractivity	73.1
Topological Polar Surface Area	63.6
Polarizability	28
Ring Count	1
Rotatable Bond Count	7

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