(4R,5R)-4-phenylmethoxy-5-(phenylmethoxymethyl)oxolan-2-one

C19H20O4 — CID 10686548

IUPAC(4R,5R)-4-phenylmethoxy-5-(phenylmethoxymethyl)oxolan-2-one
SMILESO=C1C[C@@H](OCc2ccccc2)[C@@H](COCc2ccccc2)O1
InChIInChI=1S/C19H20O4/c20-19-11-17(22-13-16-9-5-2-6-10-16)18(23-19)14-21-12-15-7-3-1-4-8-15/h1-10,17-18H,11-14H2/t17-,18-/m1/s1
InChIKeyZVNMIMFCDTZKSU-QZTJIDSGSA-N
MW312.37 g/mol
LogP3.10
Rot. Bonds7

About (4R,5R)-4-phenylmethoxy-5-(phenylmethoxymethyl)oxolan-2-one

(4R,5R)-4-phenylmethoxy-5-(phenylmethoxymethyl)oxolan-2-one (PubChem CID 10686548) has the molecular formula C19H20O4 and a molecular weight of 312.37 g/mol. Its IUPAC name is (4R,5R)-4-phenylmethoxy-5-(phenylmethoxymethyl)oxolan-2-one.

Molecular Properties

Compound Name(4R,5R)-4-phenylmethoxy-5-(phenylmethoxymethyl)oxolan-2-one
PubChem CID10686548
Molecular FormulaC19H20O4
Molecular Weight312.37 g/mol
Exact Mass312.14
IUPAC Name(4R,5R)-4-phenylmethoxy-5-(phenylmethoxymethyl)oxolan-2-one
SMILESO=C1C[C@@H](OCc2ccccc2)[C@@H](COCc2ccccc2)O1
InChIInChI=1S/C19H20O4/c20-19-11-17(22-13-16-9-5-2-6-10-16)18(23-19)14-21-12-15-7-3-1-4-8-15/h1-10,17-18H,11-14H2/t17-,18-/m1/s1
InChIKeyZVNMIMFCDTZKSU-QZTJIDSGSA-N
XLogP3.10
TPSA44.76 Ų
H-Bond Donors
H-Bond Acceptors4
Rotatable Bonds7
Heavy Atoms23
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500312.37
LogP ≤ 53.10
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 104

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Related Compounds

(4R,5S,6R)-4-phenylmethoxy-6-(phenylmethoxymethyl)-5-[(2S,3R,4S,5S,6R)-3,4,5-tris(phenylmethoxy)-6-(phenylmethoxymethyl)oxan-2-yl]oxyoxan-2-one
CID 10724297
4,5-bis(phenylmethoxy)-6-[(3-phenylmethoxyphenyl)methoxymethyl]oxan-2-one
CID 142349340
(2R,3R,4R,5R)-3,4-bis(phenylmethoxy)-2,5-bis(phenylmethoxymethyl)oxolane
CID 14020682
5-phenylmethoxy-4-(phenylmethoxymethyl)-3,3a,4,5,6,6a-hexahydrocyclopenta[b]furan-2-one
CID 14002041
(5S)-3,4,5-tris(phenylmethoxy)-6-(phenylmethoxymethyl)oxan-2-one
CID 134832144
(2R,3S,4R)-6-methylidene-3,4-bis(phenylmethoxy)-2-(phenylmethoxymethyl)oxane
CID 53391581
2-[(2R,3R,4R)-4-hydroxy-6-oxo-2-(phenylmethoxymethyl)oxan-3-yl]acetic acid
CID 70623246
[(2R,3R,4R)-6-oxo-3,4-bis(phenylmethoxy)oxan-2-yl]methyl benzoate
CID 102121862
(3R,4S,5S)-3,4-bis(phenylmethoxy)-5-(phenylmethoxymethyl)oxolan-2-one
CID 130757032
(2R,3S,4S)-3,4-bis(phenylmethoxy)-2-(phenylmethoxymethyl)oxane
CID 16688925
benzene;3,4-bis(phenylmethoxy)-2-(phenylmethoxymethyl)oxane
CID 171558653
(2R,3R,4S)-3,4-bis(phenylmethoxy)-2-(phenylmethoxymethyl)oxolane
CID 122363520

Frequently Asked Questions

What is the IUPAC name of (4R,5R)-4-phenylmethoxy-5-(phenylmethoxymethyl)oxolan-2-one?
The IUPAC name of (4R,5R)-4-phenylmethoxy-5-(phenylmethoxymethyl)oxolan-2-one (CID 10686548) is (4R,5R)-4-phenylmethoxy-5-(phenylmethoxymethyl)oxolan-2-one.
What is the SMILES notation for (4R,5R)-4-phenylmethoxy-5-(phenylmethoxymethyl)oxolan-2-one?
The canonical SMILES for (4R,5R)-4-phenylmethoxy-5-(phenylmethoxymethyl)oxolan-2-one is O=C1C[C@@H](OCc2ccccc2)[C@@H](COCc2ccccc2)O1.
What is the InChIKey of (4R,5R)-4-phenylmethoxy-5-(phenylmethoxymethyl)oxolan-2-one?
The InChIKey is ZVNMIMFCDTZKSU-QZTJIDSGSA-N. The full InChI is InChI=1S/C19H20O4/c20-19-11-17(22-13-16-9-5-2-6-10-16)18(23-19)14-21-12-15-7-3-1-4-8-15/h1-10,17-18H,11-14H2/t17-,18-/m1/s1.
What are the key properties of (4R,5R)-4-phenylmethoxy-5-(phenylmethoxymethyl)oxolan-2-one?
(4R,5R)-4-phenylmethoxy-5-(phenylmethoxymethyl)oxolan-2-one has a molecular weight of 312.37 g/mol, XLogP of 3.10, 7 rotatable bonds, 0 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for (4R,5R)-4-phenylmethoxy-5-(phenylmethoxymethyl)oxolan-2-one is sourced from PubChem (CID 10686548), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).