1-amino-3,6,9,12,15,18,21,24,27,30,33,36,39,42,45,48,51,54,57,60,63,66,69,72,75,78,81,84-octacosaoxaheptaoctacontan-87-oic acid

1-amino-3,6,9,12,15,18,21,24,27,30,33,36,39,42,45,48,51,54,57,60,63,66,69,72,75,78,81,84-octacosaoxaheptaoctacontan-87-oic acid

CAS: 196936-04-6

Formula: C59H119NO30

SMILES: NCCOCCOCCOCCOCCOCCOCCOCCOCCOCCOCCOCCOCCOCCOCCOCCOCCOCCOCCOCCOCCOCCOCCOCCOCCOCCOCCOCCOCCC(O)=O

IUPAC: 1-amino-3,6,9,12,15,18,21,24,27,30,33,36,39,42,45,48,51,54,57,60,63,66,69,72,75,78,81,84-octacosaoxaheptaoctacontan-87-oic acid

InChI: InChI=1S/C59H119NO30/c60-2-4-64-6-8-66-10-12-68-14-16-70-18-20-72-22-24-74-26-28-76-30-32-78-34-36-80-38-40-82-42-44-84-46-48-86-50-52-88-54-56-90-58-57-89-55-53-87-51-49-85-47-45-83-43-41-81-39-37-79-35-33-77-31-29-75-27-25-73-23-21-71-19-17-69-15-13-67-

Composition: C (53.58%), H (9.07%), N (1.06%), O (36.29%)

Molar Mass: 1322.578

Atom Count: 209

Heavy Atom Count: 90

Properties

Properties

Common Names	N/A
Aromatic Ring Count	0
Asymmetric Atom Count	0
Exact Mass	1321.781691436
Formal Charge	0
FSP3	0.98
Hetero Ring Count	0
Hydrogen Bond Acceptor Count	31
Hydrogen Bond Donor Count	2
InChIKey	LKFISMSLFONRBU-UHFFFAOYSA-N
Lipinski's Rule of Five
Molar Refractivity	329.92
Topological Polar Surface Area	321.76
Polarizability	131.36
Ring Count	0
Rotatable Bond Count	86

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Purity	LeadTime	CAS	PacketSize	UnitPrice
95%	<2 Days	196936-04-6		$472.50-$1,039.50$472.50$708.75$1,039.50