[(2R,3R,4R)-3,4-bis(phenylmethoxy)-3,4-dihydro-2H-pyran-2-yl]methanol

C20H22O4 — CID 11186428

IUPAC[(2R,3R,4R)-3,4-bis(phenylmethoxy)-3,4-dihydro-2H-pyran-2-yl]methanol
SMILESOC[C@H]1OC=C[C@@H](OCc2ccccc2)[C@H]1OCc1ccccc1
InChIInChI=1S/C20H22O4/c21-13-19-20(24-15-17-9-5-2-6-10-17)18(11-12-22-19)23-14-16-7-3-1-4-8-16/h1-12,18-21H,13-15H2/t18-,19-,20-/m1/s1
InChIKeyQIKRWYWXPRRUGN-VAMGGRTRSA-N
MW326.39 g/mol
LogP3.06
Rot. Bonds7

About [(2R,3R,4R)-3,4-bis(phenylmethoxy)-3,4-dihydro-2H-pyran-2-yl]methanol

[(2R,3R,4R)-3,4-bis(phenylmethoxy)-3,4-dihydro-2H-pyran-2-yl]methanol (PubChem CID 11186428) has the molecular formula C20H22O4 and a molecular weight of 326.39 g/mol. Its IUPAC name is [(2R,3R,4R)-3,4-bis(phenylmethoxy)-3,4-dihydro-2H-pyran-2-yl]methanol.

Molecular Properties

Compound Name[(2R,3R,4R)-3,4-bis(phenylmethoxy)-3,4-dihydro-2H-pyran-2-yl]methanol
PubChem CID11186428
Molecular FormulaC20H22O4
Molecular Weight326.39 g/mol
Exact Mass326.15
IUPAC Name[(2R,3R,4R)-3,4-bis(phenylmethoxy)-3,4-dihydro-2H-pyran-2-yl]methanol
SMILESOC[C@H]1OC=C[C@@H](OCc2ccccc2)[C@H]1OCc1ccccc1
InChIInChI=1S/C20H22O4/c21-13-19-20(24-15-17-9-5-2-6-10-17)18(11-12-22-19)23-14-16-7-3-1-4-8-16/h1-12,18-21H,13-15H2/t18-,19-,20-/m1/s1
InChIKeyQIKRWYWXPRRUGN-VAMGGRTRSA-N
XLogP3.06
TPSA47.92 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds7
Heavy Atoms24
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500326.39
LogP ≤ 53.06
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

(2R,3R,4R)-3,4-bis(phenylmethoxy)-2-(phenylmethoxymethyl)-3,4-dihydro-2H-pyran
CID 2734741
[3,4-bis(phenylmethoxy)-3,4-dihydro-2H-pyran-2-yl]methanol;methane;[6-methoxy-3,4-bis(phenylmethoxy)oxan-2-yl]methanol
CID 161169848
(2R,3R,4R,5S)-2-(methoxymethyl)-3,4,5-tris(phenylmethoxy)-2,3,4,5-tetrahydrooxepine
CID 102415995
[(2R,3R,4R)-3,4-bis(phenylmethoxy)-3,4-dihydro-2H-pyran-2-yl]methoxy-tri(propan-2-yl)silane
CID 10885348
[3,4-bis(phenylmethoxy)-3,4-dihydro-2H-pyran-2-yl]methyl benzoate
CID 14605865
[(2R,3R,4S,5R,6S)-3,4,5-tris(phenylmethoxy)-6-[[(2R,3S,4R)-4-phenylmethoxy-2-(phenylmethoxymethyl)-3,4-dihydro-2H-pyran-3-yl]oxy]oxan-2-yl]methanol
CID 102122335
(2R,3S,4S)-2-methoxy-3,4-bis(phenylmethoxy)-3,4-dihydro-2H-pyran
CID 101413374
(2S,3R)-3-phenylmethoxy-2-(phenylmethoxymethyl)-2,3-dihydrofuran
CID 10780268
3,4-bis(phenylmethoxy)-3,4-dihydro-2H-pyran-2-carbaldehyde
CID 167068650
[(2R,3S,4R)-4-[(4-bromophenyl)methoxy]-3-phenylmethoxy-3,4-dihydro-2H-pyran-2-yl]methoxy-tri(propan-2-yl)silane
CID 101161369
(3R,4R)-4-phenylmethoxy-2-(phenylmethoxymethyl)-3,4-dihydro-2H-pyran-3-ol
CID 58859609
(2S,3S,4R)-3,4-bis(phenylmethoxy)-2-(2-phenylmethoxypropan-2-yl)-3,4-dihydro-2H-pyran
CID 11729971

Frequently Asked Questions

What is the IUPAC name of [(2R,3R,4R)-3,4-bis(phenylmethoxy)-3,4-dihydro-2H-pyran-2-yl]methanol?
The IUPAC name of [(2R,3R,4R)-3,4-bis(phenylmethoxy)-3,4-dihydro-2H-pyran-2-yl]methanol (CID 11186428) is [(2R,3R,4R)-3,4-bis(phenylmethoxy)-3,4-dihydro-2H-pyran-2-yl]methanol.
What is the SMILES notation for [(2R,3R,4R)-3,4-bis(phenylmethoxy)-3,4-dihydro-2H-pyran-2-yl]methanol?
The canonical SMILES for [(2R,3R,4R)-3,4-bis(phenylmethoxy)-3,4-dihydro-2H-pyran-2-yl]methanol is OC[C@H]1OC=C[C@@H](OCc2ccccc2)[C@H]1OCc1ccccc1.
What is the InChIKey of [(2R,3R,4R)-3,4-bis(phenylmethoxy)-3,4-dihydro-2H-pyran-2-yl]methanol?
The InChIKey is QIKRWYWXPRRUGN-VAMGGRTRSA-N. The full InChI is InChI=1S/C20H22O4/c21-13-19-20(24-15-17-9-5-2-6-10-17)18(11-12-22-19)23-14-16-7-3-1-4-8-16/h1-12,18-21H,13-15H2/t18-,19-,20-/m1/s1.
What are the key properties of [(2R,3R,4R)-3,4-bis(phenylmethoxy)-3,4-dihydro-2H-pyran-2-yl]methanol?
[(2R,3R,4R)-3,4-bis(phenylmethoxy)-3,4-dihydro-2H-pyran-2-yl]methanol has a molecular weight of 326.39 g/mol, XLogP of 3.06, 7 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for [(2R,3R,4R)-3,4-bis(phenylmethoxy)-3,4-dihydro-2H-pyran-2-yl]methanol is sourced from PubChem (CID 11186428), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).