2,5,8,11,14-pentaoxaheptadecan-17-oic acid

2,5,8,11,14-pentaoxaheptadecan-17-oic acid

CAS: 81836-43-3

Formula: C12H24O7

SMILES: COCCOCCOCCOCCOCCC(O)=O

IUPAC: 2,5,8,11,14-pentaoxaheptadecan-17-oic acid

InChI: InChI=1S/C12H24O7/c1-15-4-5-17-8-9-19-11-10-18-7-6-16-3-2-12(13)14/h2-11H2,1H3,(H,13,14)

Composition: C (51.42%), H (8.63%), O (39.95%)

Molar Mass: 280.317

Atom Count: 43

Heavy Atom Count: 19

Properties

Properties

Common Names	N/A
Aromatic Ring Count	0
Asymmetric Atom Count	0
Exact Mass	280.152203113
Formal Charge	0
FSP3	0.92
Hetero Ring Count	0
Hydrogen Bond Acceptor Count	7
Hydrogen Bond Donor Count	1
InChIKey	KTTNUZHOERZAMX-UHFFFAOYSA-N
Lipinski's Rule of Five	1
Molar Refractivity	67.97
Topological Polar Surface Area	83.45
Polarizability	26.97
Ring Count	0
Rotatable Bond Count	15

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