(2,6-dimethoxyphenyl)-[2-(methoxymethoxy)phenyl]methanol

C17H20O5 — CID 101068033

IUPAC(2,6-dimethoxyphenyl)-[2-(methoxymethoxy)phenyl]methanol
SMILESCOCOc1ccccc1C(O)c1c(OC)cccc1OC
InChIInChI=1S/C17H20O5/c1-19-11-22-13-8-5-4-7-12(13)17(18)16-14(20-2)9-6-10-15(16)21-3/h4-10,17-18H,11H2,1-3H3
InChIKeyATAFMGUSZCENIP-UHFFFAOYSA-N
MW304.34 g/mol
LogP2.77
Rot. Bonds7

About (2,6-dimethoxyphenyl)-[2-(methoxymethoxy)phenyl]methanol

(2,6-dimethoxyphenyl)-[2-(methoxymethoxy)phenyl]methanol (PubChem CID 101068033) has the molecular formula C17H20O5 and a molecular weight of 304.34 g/mol. Its IUPAC name is (2,6-dimethoxyphenyl)-[2-(methoxymethoxy)phenyl]methanol.

Molecular Properties

Compound Name(2,6-dimethoxyphenyl)-[2-(methoxymethoxy)phenyl]methanol
PubChem CID101068033
Molecular FormulaC17H20O5
Molecular Weight304.34 g/mol
Exact Mass304.13
IUPAC Name(2,6-dimethoxyphenyl)-[2-(methoxymethoxy)phenyl]methanol
SMILESCOCOc1ccccc1C(O)c1c(OC)cccc1OC
InChIInChI=1S/C17H20O5/c1-19-11-22-13-8-5-4-7-12(13)17(18)16-14(20-2)9-6-10-15(16)21-3/h4-10,17-18H,11H2,1-3H3
InChIKeyATAFMGUSZCENIP-UHFFFAOYSA-N
XLogP2.77
TPSA57.15 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds7
Heavy Atoms22
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500304.34
LogP ≤ 52.77
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

Computed Properties (RDKit)

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

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Related Compounds

[3-methoxy-2-(methoxymethoxy)phenyl]-[2-(methoxymethoxy)phenyl]methanol
CID 19812670
(2,6-dimethoxyphenyl)-(2-fluoro-3-methylphenyl)methanol
CID 115838581
(2-chloro-3-fluorophenyl)-(2,6-dimethoxyphenyl)methanol
CID 115838575
[2-methoxy-6-(methoxymethoxy)phenyl]methanamine
CID 71420177
1-(2-methoxyphenyl)-2-(methylamino)ethanol
CID 14888491
2-amino-1-(2-methoxyphenyl)ethanol;hydrochloride
CID 54593518
2-bromo-1-(2-methoxyphenyl)ethanol
CID 53441093
(1R)-4-chloro-1-(2-methoxyphenyl)butan-1-ol
CID 94256955
(2,4-difluorophenyl)-(2,6-dimethoxyphenyl)methanol
CID 61087351
[2-(2-methoxyethoxy)phenyl]-(3-methyl-2-pyridinyl)methanol
CID 104659512
(2-ethoxyphenyl)-(3-methoxyphenyl)methanol
CID 62801888
(1R)-1-[2-(2-methoxyphenoxy)phenyl]propan-1-ol
CID 103960501

Frequently Asked Questions

What is the IUPAC name of (2,6-dimethoxyphenyl)-[2-(methoxymethoxy)phenyl]methanol?
The IUPAC name of (2,6-dimethoxyphenyl)-[2-(methoxymethoxy)phenyl]methanol (CID 101068033) is (2,6-dimethoxyphenyl)-[2-(methoxymethoxy)phenyl]methanol.
What is the SMILES notation for (2,6-dimethoxyphenyl)-[2-(methoxymethoxy)phenyl]methanol?
The canonical SMILES for (2,6-dimethoxyphenyl)-[2-(methoxymethoxy)phenyl]methanol is COCOc1ccccc1C(O)c1c(OC)cccc1OC.
What is the InChIKey of (2,6-dimethoxyphenyl)-[2-(methoxymethoxy)phenyl]methanol?
The InChIKey is ATAFMGUSZCENIP-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H20O5/c1-19-11-22-13-8-5-4-7-12(13)17(18)16-14(20-2)9-6-10-15(16)21-3/h4-10,17-18H,11H2,1-3H3.
What are the key properties of (2,6-dimethoxyphenyl)-[2-(methoxymethoxy)phenyl]methanol?
(2,6-dimethoxyphenyl)-[2-(methoxymethoxy)phenyl]methanol has a molecular weight of 304.34 g/mol, XLogP of 2.77, 7 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for (2,6-dimethoxyphenyl)-[2-(methoxymethoxy)phenyl]methanol is sourced from PubChem (CID 101068033), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).