18-methoxy-18-oxooctadecanoic acid

18-methoxy-18-oxooctadecanoic acid

CAS: 72849-35-5

Formula: C19H36O4

SMILES: COC(=O)CCCCCCCCCCCCCCCCC(O)=O

IUPAC: 18-methoxy-18-oxooctadecanoic acid

InChI: InChI=1S/C19H36O4/c1-23-19(22)17-15-13-11-9-7-5-3-2-4-6-8-10-12-14-16-18(20)21/h2-17H2,1H3,(H,20,21)

Composition: C (69.47%), H (11.05%), O (19.48%)

Molar Mass: 328.493

Atom Count: 59

Heavy Atom Count: 23

Properties

Properties

Common Names	N/A
Aromatic Ring Count	0
Asymmetric Atom Count	0
Exact Mass	328.261359639
Formal Charge	0
FSP3	0.89
Hetero Ring Count	0
Hydrogen Bond Acceptor Count	3
Hydrogen Bond Donor Count	1
InChIKey	RHRXFESGFLYUHB-UHFFFAOYSA-N
Lipinski's Rule of Five
Molar Refractivity	92.72
Topological Polar Surface Area	63.6
Polarizability	37
Ring Count	0
Rotatable Bond Count	18

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