Acetofluoro-α-D-glucose

CAT: 0024-sc-221204ASize: 5 gDry Ice: NoHazardous: No

1 / 1

CAT#:0024-sc-221204ASize:5 g

Selected

24/48H Stock Items & 2 to 6 Weeks non Stock Items.

Quick Request Actions

CAS Number

3934-29-0

Chemical Information

2,3,4,6-Tetra-O-acetyl-alpha-D-glucopyranosyl fluoride

CAS Number	3934-29-0
PubChem CID	11142654
IUPAC Name	[(2R,3R,4S,5R,6R)-3,4,5-triacetyloxy-6-fluorooxan-2-yl]methyl acetate
Molecular Formula	C14H19FO9
Molecular Weight	350.29
XLogP	1.1
Topological Polar Surface Area	114
Hydrogen Bond Donor Count	0
Hydrogen Bond Acceptor Count	10
Rotatable Bond Count	9
Heavy Atom Count	24
Formal Charge	0
Complexity	506

SMILES

CC(=O)OC[C@@H]1[C@H]([C@@H]([C@H]([C@H](O1)F)OC(=O)C)OC(=O)C)OC(=O)C

InChI

InChI=1S/C14H19FO9/c1-6(16)20-5-10-11(21-7(2)17)12(22-8(3)18)13(14(15)24-10)23-9(4)19/h10-14H,5H2,1-4H3/t10-,11-,12+,13-,14+/m1/s1

InChIKey

JJXATNWYELAACC-RGDJUOJXSA-N

Chemical Structure

2D Structure

CAS: 3934-29-0

CID: 11142654

Formula: C14H19FO9

MW: 350.29

Interactive 3D Structure

Loading 3D structure...

Computed Properties

Property	Value
Molecular Weight	350.29
XLogP3	1.1
Hydrogen Bond Donor Count	0
Hydrogen Bond Acceptor Count	10
Rotatable Bond Count	9
Exact Mass	350.10131034
Monoisotopic Mass	350.10131034
Topological Polar Surface Area	114 Å²
Heavy Atom Count	24
Formal Charge	0
Complexity	506
Isotope Atom Count	0
Defined Atom Stereocenter Count	5
Undefined Atom Stereocenter Count	0
Defined Bond Stereocenter Count	0
Undefined Bond Stereocenter Count	0
Covalently-Bonded Unit Count	1
Compound Is Canonicalized	Yes