15,16-diethynyl-2,3,5,6,8,9,11,12-octahydro-1,4,7,10,13-benzopentaoxacyclopentadecine

15,16-diethynyl-2,3,5,6,8,9,11,12-octahydro-1,4,7,10,13-benzopentaoxacyclopentadecine

Formula: C18H20O5

SMILES: C#CC1=CC2=C(OCCOCCOCCOCCO2)C=C1C#C

IUPAC: 15,16-diethynyl-2,3,5,6,8,9,11,12-octahydro-1,4,7,10,13-benzopentaoxacyclopentadecine

InChI: InChI=1S/C18H20O5/c1-3-15-13-17-18(14-16(15)4-2)23-12-10-21-8-6-19-5-7-20-9-11-22-17/h1-2,13-14H,5-12H2

Composition: C (68.34%), H (6.37%), O (25.29%)

Molar Mass: 316.353

Atom Count: 43

Heavy Atom Count: 23

Properties

Properties

Common Names	N/A
Aromatic Ring Count	1
Asymmetric Atom Count	0
Exact Mass	316.131073744
Formal Charge	0
FSP3	0.44
Hetero Ring Count	1
Hydrogen Bond Acceptor Count	5
Hydrogen Bond Donor Count	0
InChIKey	MPXODXSFYIQBBZ-UHFFFAOYSA-N
Lipinski's Rule of Five	1
Molar Refractivity	80.49
Topological Polar Surface Area	46.15
Polarizability	32.94
Ring Count	2
Rotatable Bond Count	0

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Purity	LeadTime	Formula		UnitPrice
98%	<10 Days	C18H20O5		Quote Only