4-methoxy-2,5-diphenylbenzene-1,3-diol

C19H16O3 — CID 53244203

IUPAC4-methoxy-2,5-diphenylbenzene-1,3-diol
SMILESCOc1c(-c2ccccc2)cc(O)c(-c2ccccc2)c1O
InChIInChI=1S/C19H16O3/c1-22-19-15(13-8-4-2-5-9-13)12-16(20)17(18(19)21)14-10-6-3-7-11-14/h2-12,20-21H,1H3
InChIKeyVCHUTBOIXGCCEJ-UHFFFAOYSA-N
MW292.33 g/mol
LogP4.44
Rot. Bonds3

About 4-methoxy-2,5-diphenylbenzene-1,3-diol

4-methoxy-2,5-diphenylbenzene-1,3-diol (PubChem CID 53244203) has the molecular formula C19H16O3 and a molecular weight of 292.33 g/mol. Its IUPAC name is 4-methoxy-2,5-diphenylbenzene-1,3-diol.

Molecular Properties

Compound Name4-methoxy-2,5-diphenylbenzene-1,3-diol
PubChem CID53244203
Molecular FormulaC19H16O3
Molecular Weight292.33 g/mol
Exact Mass292.11
IUPAC Name4-methoxy-2,5-diphenylbenzene-1,3-diol
SMILESCOc1c(-c2ccccc2)cc(O)c(-c2ccccc2)c1O
InChIInChI=1S/C19H16O3/c1-22-19-15(13-8-4-2-5-9-13)12-16(20)17(18(19)21)14-10-6-3-7-11-14/h2-12,20-21H,1H3
InChIKeyVCHUTBOIXGCCEJ-UHFFFAOYSA-N
XLogP4.44
TPSA49.69 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms22
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500292.33
LogP ≤ 54.44
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of 4-methoxy-2,5-diphenylbenzene-1,3-diol?
The IUPAC name of 4-methoxy-2,5-diphenylbenzene-1,3-diol (CID 53244203) is 4-methoxy-2,5-diphenylbenzene-1,3-diol.
What is the SMILES notation for 4-methoxy-2,5-diphenylbenzene-1,3-diol?
The canonical SMILES for 4-methoxy-2,5-diphenylbenzene-1,3-diol is COc1c(-c2ccccc2)cc(O)c(-c2ccccc2)c1O.
What is the InChIKey of 4-methoxy-2,5-diphenylbenzene-1,3-diol?
The InChIKey is VCHUTBOIXGCCEJ-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H16O3/c1-22-19-15(13-8-4-2-5-9-13)12-16(20)17(18(19)21)14-10-6-3-7-11-14/h2-12,20-21H,1H3.
What are the key properties of 4-methoxy-2,5-diphenylbenzene-1,3-diol?
4-methoxy-2,5-diphenylbenzene-1,3-diol has a molecular weight of 292.33 g/mol, XLogP of 4.44, 3 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 4-methoxy-2,5-diphenylbenzene-1,3-diol is sourced from PubChem (CID 53244203), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).