[3,4,6-tris(acetyloxy)-5-(2,2,2-trifluoroacetamido)oxan-2-yl]methyl acetate

[3,4,6-tris(acetyloxy)-5-(2,2,2-trifluoroacetamido)oxan-2-yl]methyl acetate

CAS: 7139-63-1

Formula: C16H20F3NO10

SMILES: CC(=O)OCC1OC(OC(C)=O)C(NC(=O)C(F)(F)F)C(OC(C)=O)C1OC(C)=O

IUPAC: [3,4,6-tris(acetyloxy)-5-(2,2,2-trifluoroacetamido)oxan-2-yl]methyl acetate

InChI: InChI=1/C16H20F3NO10/c1-6(21)26-5-10-12(27-7(2)22)13(28-8(3)23)11(14(30-10)29-9(4)24)20-15(25)16(17,18)19/h10-14H,5H2,1-4H3,(H,20,25)

Composition: C (43.35%), H (4.55%), F (12.86%), N (3.16%), O (36.09%)

Molar Mass: 443.328

Atom Count: 50

Heavy Atom Count: 30

Properties

Properties

Common Names	N/A
Aromatic Ring Count	0
Asymmetric Atom Count	5
Exact Mass	443.103930337
Formal Charge	0
FSP3	0.69
Hetero Ring Count	1
Hydrogen Bond Acceptor Count	6
Hydrogen Bond Donor Count	1
InChIKey	XSSGVGGOUZKLAR-UHFFFAOYNA-N
Lipinski's Rule of Five	1
Molar Refractivity	84.64
Topological Polar Surface Area	143.53
Polarizability	34.53
Ring Count	1
Rotatable Bond Count	11

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Purity	LeadTime	CAS	PacketSize	UnitPrice
98%	<7 Days	7139-63-1		$836.28-$1,351.71$836.28$1,351.71