1-{[(9H-fluoren-9-ylmethoxy)carbonyl]amino}-3,6,9,12-tetraoxapentadecan-15-oic acid

1-{[(9H-fluoren-9-ylmethoxy)carbonyl]amino}-3,6,9,12-tetraoxapentadecan-15-oic acid

CAS: 557756-85-1

Formula: C26H33NO8

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

IUPAC: 1-({[(9H-fluoren-9-yl)methoxy]carbonyl}amino)-3,6,9,12-tetraoxapentadecan-15-oic acid

InChI: InChI=1S/C26H33NO8/c28-25(29)9-11-31-13-15-33-17-18-34-16-14-32-12-10-27-26(30)35-19-24-22-7-3-1-5-20(22)21-6-2-4-8-23(21)24/h1-8,24H,9-19H2,(H,27,30)(H,28,29)

Composition: C (64.05%), H (6.82%), N (2.87%), O (26.25%)

Molar Mass: 487.549

Atom Count: 68

Heavy Atom Count: 35

Properties

Properties

Common Names	N/A
Aromatic Ring Count	2
Asymmetric Atom Count	0
Exact Mass	487.220617027
Formal Charge	0
FSP3	0.46
Hetero Ring Count	0
Hydrogen Bond Acceptor Count	7
Hydrogen Bond Donor Count	2
InChIKey	NUHRPLKTAAVHCZ-UHFFFAOYSA-N
Lipinski's Rule of Five	1
Molar Refractivity	128.96
Topological Polar Surface Area	112.55
Polarizability	51.52
Ring Count	3
Rotatable Bond Count	18

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