Octyl α-D-mannopyranoside

Catalog	DGS124650299
CAS	124650-29-9
Synonyms	a-D-Mannopyranoside, octyl
IUPAC Name	(2R,3S,4S,5S,6S)-2-(hydroxymethyl)-6-octoxyoxane-3,4,5-triol
Molecular Weight	292.37
Molecular Formula	C14H28O6
InChI	InChI=1S/C14H28O6/c1-2-3-4-5-6-7-8-19-14-13(18)12(17)11(16)10(9-15)20-14/h10-18H,2-9H2,1H3/t10-,11-,12+,13+,14+/m1/s1
InChI Key	HEGSGKPQLMEBJL-DGTMBMJNSA-N
Purity	≥95%
Appearance	White solid
Complexity	250
Exact Mass	292.18858861
Formal Charge	0
Heavy Atom Count	20
Hydrogen Bond Acceptor Count	6
Hydrogen Bond Donor Count	4
Isomeric SMILES	CCCCCCCCO[C@@H]1[C@H]([C@H]([C@@H]([C@H](O1)CO)O)O)O
MDL Number	MFCD18642959
Monoisotopic Mass	292.18858861
Rotatable Bond Count	9
Topological Polar Surface Area	99.4 Ų
XLogP3-AA	1.4