[2-(hydroxymethyl)-6-methoxyphenyl]-(4-methoxyphenyl)methanol

C16H18O4 — CID 15548223

IUPAC[2-(hydroxymethyl)-6-methoxyphenyl]-(4-methoxyphenyl)methanol
SMILESCOc1ccc(C(O)c2c(CO)cccc2OC)cc1
InChIInChI=1S/C16H18O4/c1-19-13-8-6-11(7-9-13)16(18)15-12(10-17)4-3-5-14(15)20-2/h3-9,16-18H,10H2,1-2H3
InChIKeyXMQURCIUQRJOLL-UHFFFAOYSA-N
MW274.32 g/mol
LogP2.28
Rot. Bonds5

About [2-(hydroxymethyl)-6-methoxyphenyl]-(4-methoxyphenyl)methanol

[2-(hydroxymethyl)-6-methoxyphenyl]-(4-methoxyphenyl)methanol (PubChem CID 15548223) has the molecular formula C16H18O4 and a molecular weight of 274.32 g/mol. Its IUPAC name is [2-(hydroxymethyl)-6-methoxyphenyl]-(4-methoxyphenyl)methanol.

Molecular Properties

Compound Name[2-(hydroxymethyl)-6-methoxyphenyl]-(4-methoxyphenyl)methanol
PubChem CID15548223
Molecular FormulaC16H18O4
Molecular Weight274.32 g/mol
Exact Mass274.12
IUPAC Name[2-(hydroxymethyl)-6-methoxyphenyl]-(4-methoxyphenyl)methanol
SMILESCOc1ccc(C(O)c2c(CO)cccc2OC)cc1
InChIInChI=1S/C16H18O4/c1-19-13-8-6-11(7-9-13)16(18)15-12(10-17)4-3-5-14(15)20-2/h3-9,16-18H,10H2,1-2H3
InChIKeyXMQURCIUQRJOLL-UHFFFAOYSA-N
XLogP2.28
TPSA58.92 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds5
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500274.32
LogP ≤ 52.28
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

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Related Compounds

1-(2,6-dimethoxyphenyl)-2-(4-methoxyphenyl)ethanol
CID 63018245
[2-[2-amino-1-(4-methoxyphenyl)propoxy]phenyl]methanol
CID 63652901
(2-(111C)methoxyphenyl)methanol
CID 59897789
(2,6-dimethoxyphenyl)-[4-(dimethylamino)phenyl]methanol
CID 116809671
3-[2-[hydroxy-(4-methoxyphenyl)methyl]phenyl]propan-1-ol
CID 13385960
1-(2,6-dimethoxyphenyl)-2-(2-methoxyphenyl)ethanol
CID 63018829
[2-[2-(4-methoxyphenoxy)ethoxy]phenyl]methanol
CID 60773075
(2-bromo-6-fluorophenyl)-(4-methoxyphenyl)methanol
CID 114560429
2-(2-methoxyphenyl)-1-(4-methoxyphenyl)propane-1,3-diol
CID 164900088
(2-bromo-3-methoxyphenyl)methanol
CID 54103130
2-methoxy-6-[[[(1R)-1-(4-methoxyphenyl)ethyl]amino]methyl]phenol
CID 81367015
(4-methoxyphenyl)-(2-methyl-1-benzofuran-3-yl)methanol
CID 15307875

Frequently Asked Questions

What is the IUPAC name of [2-(hydroxymethyl)-6-methoxyphenyl]-(4-methoxyphenyl)methanol?
The IUPAC name of [2-(hydroxymethyl)-6-methoxyphenyl]-(4-methoxyphenyl)methanol (CID 15548223) is [2-(hydroxymethyl)-6-methoxyphenyl]-(4-methoxyphenyl)methanol.
What is the SMILES notation for [2-(hydroxymethyl)-6-methoxyphenyl]-(4-methoxyphenyl)methanol?
The canonical SMILES for [2-(hydroxymethyl)-6-methoxyphenyl]-(4-methoxyphenyl)methanol is COc1ccc(C(O)c2c(CO)cccc2OC)cc1.
What is the InChIKey of [2-(hydroxymethyl)-6-methoxyphenyl]-(4-methoxyphenyl)methanol?
The InChIKey is XMQURCIUQRJOLL-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H18O4/c1-19-13-8-6-11(7-9-13)16(18)15-12(10-17)4-3-5-14(15)20-2/h3-9,16-18H,10H2,1-2H3.
What are the key properties of [2-(hydroxymethyl)-6-methoxyphenyl]-(4-methoxyphenyl)methanol?
[2-(hydroxymethyl)-6-methoxyphenyl]-(4-methoxyphenyl)methanol has a molecular weight of 274.32 g/mol, XLogP of 2.28, 5 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for [2-(hydroxymethyl)-6-methoxyphenyl]-(4-methoxyphenyl)methanol is sourced from PubChem (CID 15548223), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).