(3,5-dimethoxyphenyl)-(3-phenylmethoxyphenyl)methanol

C22H22O4 — CID 69204493

IUPAC(3,5-dimethoxyphenyl)-(3-phenylmethoxyphenyl)methanol
SMILESCOc1cc(OC)cc(C(O)c2cccc(OCc3ccccc3)c2)c1
InChIInChI=1S/C22H22O4/c1-24-20-12-18(13-21(14-20)25-2)22(23)17-9-6-10-19(11-17)26-15-16-7-4-3-5-8-16/h3-14,22-23H,15H2,1-2H3
InChIKeyTXPXOGPKXUQCOA-UHFFFAOYSA-N
MW350.41 g/mol
LogP4.36
Rot. Bonds7

About (3,5-dimethoxyphenyl)-(3-phenylmethoxyphenyl)methanol

(3,5-dimethoxyphenyl)-(3-phenylmethoxyphenyl)methanol (PubChem CID 69204493) has the molecular formula C22H22O4 and a molecular weight of 350.41 g/mol. Its IUPAC name is (3,5-dimethoxyphenyl)-(3-phenylmethoxyphenyl)methanol.

Molecular Properties

Compound Name(3,5-dimethoxyphenyl)-(3-phenylmethoxyphenyl)methanol
PubChem CID69204493
Molecular FormulaC22H22O4
Molecular Weight350.41 g/mol
Exact Mass350.15
IUPAC Name(3,5-dimethoxyphenyl)-(3-phenylmethoxyphenyl)methanol
SMILESCOc1cc(OC)cc(C(O)c2cccc(OCc3ccccc3)c2)c1
InChIInChI=1S/C22H22O4/c1-24-20-12-18(13-21(14-20)25-2)22(23)17-9-6-10-19(11-17)26-15-16-7-4-3-5-8-16/h3-14,22-23H,15H2,1-2H3
InChIKeyTXPXOGPKXUQCOA-UHFFFAOYSA-N
XLogP4.36
TPSA47.92 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds7
Heavy Atoms26
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500350.41
LogP ≤ 54.36
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

1-(3-phenylmethoxyphenyl)propane-1,2-diol
CID 137375721
(1S,2R)-1-amino-1-(3-phenylmethoxyphenyl)propan-2-ol
CID 171270166
(3-phenylmethoxyphenyl)-thiophen-2-ylmethanol
CID 2904667
3,5-bis(3-phenylmethoxyphenyl)heptan-4-one
CID 139719265
N,3-dimethyl-1-(3-phenylmethoxyphenyl)but-2-en-1-amine
CID 105163254
methyl 1-[4-[[3-[hydroxy(phenyl)methyl]phenoxy]methyl]phenyl]cyclopropane-1-carboxylate
CID 71113166
[1-(benzenesulfonyl)-5-methoxyindol-2-yl]-(3-phenylmethoxyphenyl)methanol
CID 11081611
(2R)-2-amino-2-(3-phenylmethoxyphenyl)ethanol
CID 66515455
2-methoxy-2-(3-phenylmethoxyphenyl)acetaldehyde
CID 87552555
2-[hydroxy-(3-phenylmethoxyphenyl)methyl]butanoic acid
CID 67882455
1-[3,5-bis(phenylmethoxy)phenyl]-2-bromoethanol
CID 11640220
(1S)-2,2-dimethyl-1-(3-phenylmethoxyphenyl)propan-1-amine;hydrochloride
CID 171243477

Frequently Asked Questions

What is the IUPAC name of (3,5-dimethoxyphenyl)-(3-phenylmethoxyphenyl)methanol?
The IUPAC name of (3,5-dimethoxyphenyl)-(3-phenylmethoxyphenyl)methanol (CID 69204493) is (3,5-dimethoxyphenyl)-(3-phenylmethoxyphenyl)methanol.
What is the SMILES notation for (3,5-dimethoxyphenyl)-(3-phenylmethoxyphenyl)methanol?
The canonical SMILES for (3,5-dimethoxyphenyl)-(3-phenylmethoxyphenyl)methanol is COc1cc(OC)cc(C(O)c2cccc(OCc3ccccc3)c2)c1.
What is the InChIKey of (3,5-dimethoxyphenyl)-(3-phenylmethoxyphenyl)methanol?
The InChIKey is TXPXOGPKXUQCOA-UHFFFAOYSA-N. The full InChI is InChI=1S/C22H22O4/c1-24-20-12-18(13-21(14-20)25-2)22(23)17-9-6-10-19(11-17)26-15-16-7-4-3-5-8-16/h3-14,22-23H,15H2,1-2H3.
What are the key properties of (3,5-dimethoxyphenyl)-(3-phenylmethoxyphenyl)methanol?
(3,5-dimethoxyphenyl)-(3-phenylmethoxyphenyl)methanol has a molecular weight of 350.41 g/mol, XLogP of 4.36, 7 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for (3,5-dimethoxyphenyl)-(3-phenylmethoxyphenyl)methanol is sourced from PubChem (CID 69204493), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).