N-(3,6,9,12,15,18,21,24,27,30,33,36-dodecaoxanonatriacont-38-yn-1-yl)bicyclo[2.2.1]hept-5-ene-2-carboxamide

N-(3,6,9,12,15,18,21,24,27,30,33,36-dodecaoxanonatriacont-38-yn-1-yl)bicyclo[2.2.1]hept-5-ene-2-carboxamide

Formula: C35H61NO13

SMILES: O=C(NCCOCCOCCOCCOCCOCCOCCOCCOCCOCCOCCOCCOCC#C)C1CC2CC1C=C2

IUPAC: N-(3,6,9,12,15,18,21,24,27,30,33,36-dodecaoxanonatriacont-38-yn-1-yl)bicyclo[2.2.1]hept-5-ene-2-carboxamide

InChI: InChI=1/C35H61NO13/c1-2-6-38-8-10-40-12-14-42-16-18-44-20-22-46-24-26-48-28-29-49-27-25-47-23-21-45-19-17-43-15-13-41-11-9-39-7-5-36-35(37)34-31-32-3-4-33(34)30-32/h1,3-4,32-34H,5-31H2,(H,36,37)

Composition: C (59.73%), H (8.74%), N (1.99%), O (29.55%)

Molar Mass: 703.867

Atom Count: 110

Heavy Atom Count: 49

Properties

Properties

Common Names	N/A
Aromatic Ring Count	0
Asymmetric Atom Count	3
Exact Mass	703.414291028
Formal Charge	0
FSP3	0.86
Hetero Ring Count	0
Hydrogen Bond Acceptor Count	13
Hydrogen Bond Donor Count	1
InChIKey	JIGCEKYFQSBQOY-UHFFFAOYNA-N
Lipinski's Rule of Five
Molar Refractivity	184.48
Topological Polar Surface Area	139.86
Polarizability	72.07
Ring Count	2
Rotatable Bond Count	38

Suppliers

Axispharm

Supplier Profile

Purity	LeadTime	Formula	PacketSize	UnitPrice
95%	<2 Days	C35H61NO13		$453.60-$2,523.15$453.60$926.10$1,682.10$2,523.15