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

C10H18O6 — CID 53362330

IUPAC[(2R,3S,4R)-3,4-bis(methoxymethoxy)-3,4-dihydro-2H-pyran-2-yl]methanol
SMILESCOCO[C@H]1[C@H](OCOC)C=CO[C@@H]1CO
InChIInChI=1S/C10H18O6/c1-12-6-15-8-3-4-14-9(5-11)10(8)16-7-13-2/h3-4,8-11H,5-7H2,1-2H3/t8-,9-,10+/m1/s1
InChIKeyMUCRONSHSADEGB-BBBLOLIVSA-N
MW234.25 g/mol
LogP-0.13
Rot. Bonds7

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

[(2R,3S,4R)-3,4-bis(methoxymethoxy)-3,4-dihydro-2H-pyran-2-yl]methanol (PubChem CID 53362330) has the molecular formula C10H18O6 and a molecular weight of 234.25 g/mol. Its IUPAC name is [(2R,3S,4R)-3,4-bis(methoxymethoxy)-3,4-dihydro-2H-pyran-2-yl]methanol.

Molecular Properties

Compound Name[(2R,3S,4R)-3,4-bis(methoxymethoxy)-3,4-dihydro-2H-pyran-2-yl]methanol
PubChem CID53362330
Molecular FormulaC10H18O6
Molecular Weight234.25 g/mol
Exact Mass234.11
IUPAC Name[(2R,3S,4R)-3,4-bis(methoxymethoxy)-3,4-dihydro-2H-pyran-2-yl]methanol
SMILESCOCO[C@H]1[C@H](OCOC)C=CO[C@@H]1CO
InChIInChI=1S/C10H18O6/c1-12-6-15-8-3-4-14-9(5-11)10(8)16-7-13-2/h3-4,8-11H,5-7H2,1-2H3/t8-,9-,10+/m1/s1
InChIKeyMUCRONSHSADEGB-BBBLOLIVSA-N
XLogP-0.13
TPSA66.38 Ų
H-Bond Donors1
H-Bond Acceptors6
Rotatable Bonds7
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500234.25
LogP ≤ 5-0.13
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 106

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'het-C-het_not_in_ring', 'substructure': 'N/A'}

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Related Compounds

4-Penten-2-ol, 3-[(2-methoxyethoxy)methoxy]-, (2S,3S)-
CID 11424055
(R)-1-((4R,5S)-2,2-Dimethyl-5-vinyl-1,3-dioxolan-4-yl)ethane-1,2-diol
CID 11063164
1-[(4R,5S)-5-ethenyl-2,2-dimethyl-1,3-dioxolan-4-yl]ethane-1,2-diol
CID 155185118
(1R)-1-[(4R,5R)-5-ethenyl-2,2-dimethyl-1,3-dioxolan-4-yl]ethane-1,2-diol
CID 11263931
4-(Methoxymethoxy)hex-5-en-3-ol
CID 12916897
(2R,4S)-4-(2-methoxyethoxymethoxy)hex-5-en-2-ol
CID 24823369
(4S,6R)-6-(2-methoxyethoxymethoxy)octa-1,7-dien-4-ol
CID 71567153
(4S,5R,6R)-5,6-bis(methoxymethoxy)hept-1-en-4-ol
CID 102144558
(4R,5R,6R)-5,6-bis(methoxymethoxy)hept-1-en-4-ol
CID 102144559
(2S,3R)-3-(2-methoxyethoxymethoxy)pent-4-en-2-ol
CID 124647096
(3aS,8R,8aR)-2,2-dimethyl-3a,7,8,8a-tetrahydro-[1,3]dioxolo[4,5-d]oxepin-8-ol
CID 130848340
(2R,3R,4R)-3,4-bis(methoxymethoxy)-2-methyl-3,4-dihydro-2H-pyran
CID 134834586

Frequently Asked Questions

What is the IUPAC name of [(2R,3S,4R)-3,4-bis(methoxymethoxy)-3,4-dihydro-2H-pyran-2-yl]methanol?
The IUPAC name of [(2R,3S,4R)-3,4-bis(methoxymethoxy)-3,4-dihydro-2H-pyran-2-yl]methanol (CID 53362330) is [(2R,3S,4R)-3,4-bis(methoxymethoxy)-3,4-dihydro-2H-pyran-2-yl]methanol.
What is the SMILES notation for [(2R,3S,4R)-3,4-bis(methoxymethoxy)-3,4-dihydro-2H-pyran-2-yl]methanol?
The canonical SMILES for [(2R,3S,4R)-3,4-bis(methoxymethoxy)-3,4-dihydro-2H-pyran-2-yl]methanol is COCO[C@H]1[C@H](OCOC)C=CO[C@@H]1CO.
What is the InChIKey of [(2R,3S,4R)-3,4-bis(methoxymethoxy)-3,4-dihydro-2H-pyran-2-yl]methanol?
The InChIKey is MUCRONSHSADEGB-BBBLOLIVSA-N. The full InChI is InChI=1S/C10H18O6/c1-12-6-15-8-3-4-14-9(5-11)10(8)16-7-13-2/h3-4,8-11H,5-7H2,1-2H3/t8-,9-,10+/m1/s1.
What are the key properties of [(2R,3S,4R)-3,4-bis(methoxymethoxy)-3,4-dihydro-2H-pyran-2-yl]methanol?
[(2R,3S,4R)-3,4-bis(methoxymethoxy)-3,4-dihydro-2H-pyran-2-yl]methanol has a molecular weight of 234.25 g/mol, XLogP of -0.13, 7 rotatable bonds, 1 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for [(2R,3S,4R)-3,4-bis(methoxymethoxy)-3,4-dihydro-2H-pyran-2-yl]methanol is sourced from PubChem (CID 53362330), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).