20-{[(9H-fluoren-9-ylmethoxy)carbonyl]amino}-3,6,9,12,15,18-hexaoxaicosanoic acid

20-{[(9H-fluoren-9-ylmethoxy)carbonyl]amino}-3,6,9,12,15,18-hexaoxaicosanoic acid

CAS: 437655-96-4

Formula: C29H39NO10

SMILES: OC(=O)COCCOCCOCCOCCOCCOCCNC(=O)OCC1C2=CC=CC=C2C2=CC=CC=C12

IUPAC: 20-({[(9H-fluoren-9-yl)methoxy]carbonyl}amino)-3,6,9,12,15,18-hexaoxaicosanoic acid

InChI: InChI=1S/C29H39NO10/c31-28(32)22-39-20-19-38-18-17-37-16-15-36-14-13-35-12-11-34-10-9-30-29(33)40-21-27-25-7-3-1-5-23(25)24-6-2-4-8-26(24)27/h1-8,27H,9-22H2,(H,30,33)(H,31,32)

Composition: C (62.02%), H (7.00%), N (2.49%), O (28.49%)

Molar Mass: 561.628

Atom Count: 79

Heavy Atom Count: 40

Properties

Properties

Common Names	N/A
Aromatic Ring Count	2
Asymmetric Atom Count	0
Exact Mass	561.25739646
Formal Charge	0
FSP3	0.52
Hetero Ring Count	0
Hydrogen Bond Acceptor Count	9
Hydrogen Bond Donor Count	2
InChIKey	HANLHKUCDRJGKX-UHFFFAOYSA-N
Lipinski's Rule of Five
Molar Refractivity	146.34
Topological Polar Surface Area	131.01
Polarizability	58.46
Ring Count	3
Rotatable Bond Count	23

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