[(2R,3R,4R)-4-fluoro-2-(methoxycarbonyloxymethyl)-5-methyloxolan-3-yl] methyl carbonate

C10H15FO7 — CID 146406641

IUPAC[(2R,3R,4R)-4-fluoro-2-(methoxycarbonyloxymethyl)-5-methyloxolan-3-yl] methyl carbonate
SMILESCOC(=O)OC[C@H]1OC(C)[C@@H](F)[C@@H]1OC(=O)OC
InChIInChI=1S/C10H15FO7/c1-5-7(11)8(18-10(13)15-3)6(17-5)4-16-9(12)14-2/h5-8H,4H2,1-3H3/t5?,6-,7-,8-/m1/s1
InChIKeyNAJMVMNHARIZTQ-UIYHXYAWSA-N
MW266.22 g/mol
LogP1.05
Rot. Bonds3

About [(2R,3R,4R)-4-fluoro-2-(methoxycarbonyloxymethyl)-5-methyloxolan-3-yl] methyl carbonate

[(2R,3R,4R)-4-fluoro-2-(methoxycarbonyloxymethyl)-5-methyloxolan-3-yl] methyl carbonate (PubChem CID 146406641) has the molecular formula C10H15FO7 and a molecular weight of 266.22 g/mol. Its IUPAC name is [(2R,3R,4R)-4-fluoro-2-(methoxycarbonyloxymethyl)-5-methyloxolan-3-yl] methyl carbonate.

Molecular Properties

Compound Name[(2R,3R,4R)-4-fluoro-2-(methoxycarbonyloxymethyl)-5-methyloxolan-3-yl] methyl carbonate
PubChem CID146406641
Molecular FormulaC10H15FO7
Molecular Weight266.22 g/mol
Exact Mass266.08
IUPAC Name[(2R,3R,4R)-4-fluoro-2-(methoxycarbonyloxymethyl)-5-methyloxolan-3-yl] methyl carbonate
SMILESCOC(=O)OC[C@H]1OC(C)[C@@H](F)[C@@H]1OC(=O)OC
InChIInChI=1S/C10H15FO7/c1-5-7(11)8(18-10(13)15-3)6(17-5)4-16-9(12)14-2/h5-8H,4H2,1-3H3/t5?,6-,7-,8-/m1/s1
InChIKeyNAJMVMNHARIZTQ-UIYHXYAWSA-N
XLogP1.05
TPSA80.29 Ų
H-Bond Donors
H-Bond Acceptors7
Rotatable Bonds3
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500266.22
LogP ≤ 51.05
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 107

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Related Compounds

[(2R,3R,4R)-3-(4-chlorobenzoyl)oxy-4-fluoro-5-methyloxolan-2-yl]methyl 4-chlorobenzoate
CID 146406661
[(2R,3R,4S,5R,6R)-6-ethoxy-3,4,5-tris(methoxycarbonyloxy)oxan-2-yl]methyl acetate
CID 71267653
[(3R)-4-fluoro-5-methyl-3-[(E)-3-phenylprop-2-enoyl]oxyoxolan-2-yl]methyl (E)-3-phenylprop-2-enoate
CID 144573211
(3-acetyloxy-6-bromo-4-fluoro-5-methyloxan-2-yl)methyl acetate
CID 58981665
[(2R,3S,5R)-5-hydroxy-3-methoxycarbonyloxy-4,4-dimethyloxolan-2-yl]methyl methyl carbonate
CID 170293492
[(2R,3S,4S,5S)-3-acetyloxy-4,5-dimethyloxolan-2-yl]methyl acetate
CID 58159411
[(3S,4S,6S)-5-acetyloxy-3,4-dimethoxy-6-methyloxan-2-yl]methyl acetate
CID 58919166
(2R,3S,5S)-4-fluoro-3-methoxy-2-(methoxymethyl)-5-methyloxolane;(2S,4R,5R)-4-methoxy-5-(methoxymethyl)-2-methyloxolan-3-ol
CID 158901360
[(3S,4R,6S)-3,4-diacetyloxy-5,6-dimethyloxan-2-yl]methyl acetate
CID 71155336
methyl [(2R,3S,4S,5R)-3,4,5,6-tetrahydroxyoxan-2-yl]methyl carbonate
CID 10331746
methyl [(2R,3S,4S,5S)-3,4,5,6-tetrahydroxyoxan-2-yl]methyl carbonate
CID 10399290
[(2R,3R,4S,6S)-3,4,6-triacetyloxy-5-(18F)fluorooxan-2-yl]methyl acetate
CID 11068051

Frequently Asked Questions

What is the IUPAC name of [(2R,3R,4R)-4-fluoro-2-(methoxycarbonyloxymethyl)-5-methyloxolan-3-yl] methyl carbonate?
The IUPAC name of [(2R,3R,4R)-4-fluoro-2-(methoxycarbonyloxymethyl)-5-methyloxolan-3-yl] methyl carbonate (CID 146406641) is [(2R,3R,4R)-4-fluoro-2-(methoxycarbonyloxymethyl)-5-methyloxolan-3-yl] methyl carbonate.
What is the SMILES notation for [(2R,3R,4R)-4-fluoro-2-(methoxycarbonyloxymethyl)-5-methyloxolan-3-yl] methyl carbonate?
The canonical SMILES for [(2R,3R,4R)-4-fluoro-2-(methoxycarbonyloxymethyl)-5-methyloxolan-3-yl] methyl carbonate is COC(=O)OC[C@H]1OC(C)[C@@H](F)[C@@H]1OC(=O)OC.
What is the InChIKey of [(2R,3R,4R)-4-fluoro-2-(methoxycarbonyloxymethyl)-5-methyloxolan-3-yl] methyl carbonate?
The InChIKey is NAJMVMNHARIZTQ-UIYHXYAWSA-N. The full InChI is InChI=1S/C10H15FO7/c1-5-7(11)8(18-10(13)15-3)6(17-5)4-16-9(12)14-2/h5-8H,4H2,1-3H3/t5?,6-,7-,8-/m1/s1.
What are the key properties of [(2R,3R,4R)-4-fluoro-2-(methoxycarbonyloxymethyl)-5-methyloxolan-3-yl] methyl carbonate?
[(2R,3R,4R)-4-fluoro-2-(methoxycarbonyloxymethyl)-5-methyloxolan-3-yl] methyl carbonate has a molecular weight of 266.22 g/mol, XLogP of 1.05, 3 rotatable bonds, 0 hydrogen bond donors, and 7 hydrogen bond acceptors.
Where does this data come from?
All data for [(2R,3R,4R)-4-fluoro-2-(methoxycarbonyloxymethyl)-5-methyloxolan-3-yl] methyl carbonate is sourced from PubChem (CID 146406641), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).