(2R,3S,4R,6S)-2-methyl-3,6-bis(phenylmethoxy)oxan-4-ol

C20H24O4 — CID 14466621

IUPAC(2R,3S,4R,6S)-2-methyl-3,6-bis(phenylmethoxy)oxan-4-ol
SMILESC[C@H]1O[C@H](OCc2ccccc2)C[C@@H](O)[C@@H]1OCc1ccccc1
InChIInChI=1S/C20H24O4/c1-15-20(23-14-17-10-6-3-7-11-17)18(21)12-19(24-15)22-13-16-8-4-2-5-9-16/h2-11,15,18-21H,12-14H2,1H3/t15-,18-,19+,20-/m1/s1
InChIKeyZIZCEISOGNFDNY-GEALJGNFSA-N
MW328.41 g/mol
LogP3.28
Rot. Bonds6

About (2R,3S,4R,6S)-2-methyl-3,6-bis(phenylmethoxy)oxan-4-ol

(2R,3S,4R,6S)-2-methyl-3,6-bis(phenylmethoxy)oxan-4-ol (PubChem CID 14466621) has the molecular formula C20H24O4 and a molecular weight of 328.41 g/mol. Its IUPAC name is (2R,3S,4R,6S)-2-methyl-3,6-bis(phenylmethoxy)oxan-4-ol.

Molecular Properties

Compound Name(2R,3S,4R,6S)-2-methyl-3,6-bis(phenylmethoxy)oxan-4-ol
PubChem CID14466621
Molecular FormulaC20H24O4
Molecular Weight328.41 g/mol
Exact Mass328.17
IUPAC Name(2R,3S,4R,6S)-2-methyl-3,6-bis(phenylmethoxy)oxan-4-ol
SMILESC[C@H]1O[C@H](OCc2ccccc2)C[C@@H](O)[C@@H]1OCc1ccccc1
InChIInChI=1S/C20H24O4/c1-15-20(23-14-17-10-6-3-7-11-17)18(21)12-19(24-15)22-13-16-8-4-2-5-9-16/h2-11,15,18-21H,12-14H2,1H3/t15-,18-,19+,20-/m1/s1
InChIKeyZIZCEISOGNFDNY-GEALJGNFSA-N
XLogP3.28
TPSA47.92 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds6
Heavy Atoms24
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500328.41
LogP ≤ 53.28
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

Analyze (2R,3S,4R,6S)-2-methyl-3,6-bis(phenylmethoxy)oxan-4-ol with MolForge

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Related Compounds

(1S,2R,4S,6R)-2-methyl-4-phenylmethoxy-3,7-dioxabicyclo[4.1.0]heptane
CID 101187707
2-methyl-6-phenylmethoxyoxan-4-ol
CID 162749545
(5S)-6-methyl-4,5-bis(phenylmethoxy)oxan-2-ol
CID 126612131
(2S,3S,5S)-2,6-dimethyl-4-phenylmethoxyoxane-3,5-diol
CID 167585367
(2R,3S,4S,5R,6R)-2-methyl-3,5,6-tris(phenylmethoxy)oxan-4-ol
CID 11080578
(2R,3R,4S,5R)-2-(hydroxymethyl)-5-methyl-4-phenylmethoxyoxolan-3-ol
CID 58747870
(1S,2R,3R,4R,5R)-5-methyl-2,3,4-tris(phenylmethoxy)cyclohexan-1-ol
CID 10025814
(1S,3R,4S)-5-methyl-2,3,4-tris(phenylmethoxy)cyclohexan-1-ol
CID 70901451
(2R,3S,4R,6S)-3-[tert-butyl(dimethyl)silyl]oxy-6-[(2R,3R,4R,6R)-4-[tert-butyl(dimethyl)silyl]oxy-2-methyl-6-phenylmethoxyoxan-3-yl]oxy-2-methyloxan-4-ol
CID 24897800
(2R,3R,4S,5R,6S)-2-methoxy-6-methyl-5-phenylmethoxyoxane-3,4-diol
CID 1284354
(2S,3R,4S,5S,6S)-2-methoxy-6-methyl-4,5-bis(phenylmethoxy)oxan-3-ol
CID 10808327
[(2S,3S,4R,5S,6S)-6-methyl-3,4,5-tris(phenylmethoxy)oxan-2-yl]methanol
CID 170405483

Frequently Asked Questions

What is the IUPAC name of (2R,3S,4R,6S)-2-methyl-3,6-bis(phenylmethoxy)oxan-4-ol?
The IUPAC name of (2R,3S,4R,6S)-2-methyl-3,6-bis(phenylmethoxy)oxan-4-ol (CID 14466621) is (2R,3S,4R,6S)-2-methyl-3,6-bis(phenylmethoxy)oxan-4-ol.
What is the SMILES notation for (2R,3S,4R,6S)-2-methyl-3,6-bis(phenylmethoxy)oxan-4-ol?
The canonical SMILES for (2R,3S,4R,6S)-2-methyl-3,6-bis(phenylmethoxy)oxan-4-ol is C[C@H]1O[C@H](OCc2ccccc2)C[C@@H](O)[C@@H]1OCc1ccccc1.
What is the InChIKey of (2R,3S,4R,6S)-2-methyl-3,6-bis(phenylmethoxy)oxan-4-ol?
The InChIKey is ZIZCEISOGNFDNY-GEALJGNFSA-N. The full InChI is InChI=1S/C20H24O4/c1-15-20(23-14-17-10-6-3-7-11-17)18(21)12-19(24-15)22-13-16-8-4-2-5-9-16/h2-11,15,18-21H,12-14H2,1H3/t15-,18-,19+,20-/m1/s1.
What are the key properties of (2R,3S,4R,6S)-2-methyl-3,6-bis(phenylmethoxy)oxan-4-ol?
(2R,3S,4R,6S)-2-methyl-3,6-bis(phenylmethoxy)oxan-4-ol has a molecular weight of 328.41 g/mol, XLogP of 3.28, 6 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for (2R,3S,4R,6S)-2-methyl-3,6-bis(phenylmethoxy)oxan-4-ol is sourced from PubChem (CID 14466621), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).