4-(methoxymethoxy)-3-[4-(methoxymethoxy)phenyl]phenol

C16H18O5 — CID 71619534

IUPAC4-(methoxymethoxy)-3-[4-(methoxymethoxy)phenyl]phenol
SMILESCOCOc1ccc(-c2cc(O)ccc2OCOC)cc1
InChIInChI=1S/C16H18O5/c1-18-10-20-14-6-3-12(4-7-14)15-9-13(17)5-8-16(15)21-11-19-2/h3-9,17H,10-11H2,1-2H3
InChIKeyBJBSZUYIWCKKBU-UHFFFAOYSA-N
MW290.32 g/mol
LogP3.02
Rot. Bonds7

About 4-(methoxymethoxy)-3-[4-(methoxymethoxy)phenyl]phenol

4-(methoxymethoxy)-3-[4-(methoxymethoxy)phenyl]phenol (PubChem CID 71619534) has the molecular formula C16H18O5 and a molecular weight of 290.32 g/mol. Its IUPAC name is 4-(methoxymethoxy)-3-[4-(methoxymethoxy)phenyl]phenol.

Molecular Properties

Compound Name4-(methoxymethoxy)-3-[4-(methoxymethoxy)phenyl]phenol
PubChem CID71619534
Molecular FormulaC16H18O5
Molecular Weight290.32 g/mol
Exact Mass290.12
IUPAC Name4-(methoxymethoxy)-3-[4-(methoxymethoxy)phenyl]phenol
SMILESCOCOc1ccc(-c2cc(O)ccc2OCOC)cc1
InChIInChI=1S/C16H18O5/c1-18-10-20-14-6-3-12(4-7-14)15-9-13(17)5-8-16(15)21-11-19-2/h3-9,17H,10-11H2,1-2H3
InChIKeyBJBSZUYIWCKKBU-UHFFFAOYSA-N
XLogP3.02
TPSA57.15 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds7
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500290.32
LogP ≤ 53.02
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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Frequently Asked Questions

What is the IUPAC name of 4-(methoxymethoxy)-3-[4-(methoxymethoxy)phenyl]phenol?
The IUPAC name of 4-(methoxymethoxy)-3-[4-(methoxymethoxy)phenyl]phenol (CID 71619534) is 4-(methoxymethoxy)-3-[4-(methoxymethoxy)phenyl]phenol.
What is the SMILES notation for 4-(methoxymethoxy)-3-[4-(methoxymethoxy)phenyl]phenol?
The canonical SMILES for 4-(methoxymethoxy)-3-[4-(methoxymethoxy)phenyl]phenol is COCOc1ccc(-c2cc(O)ccc2OCOC)cc1.
What is the InChIKey of 4-(methoxymethoxy)-3-[4-(methoxymethoxy)phenyl]phenol?
The InChIKey is BJBSZUYIWCKKBU-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H18O5/c1-18-10-20-14-6-3-12(4-7-14)15-9-13(17)5-8-16(15)21-11-19-2/h3-9,17H,10-11H2,1-2H3.
What are the key properties of 4-(methoxymethoxy)-3-[4-(methoxymethoxy)phenyl]phenol?
4-(methoxymethoxy)-3-[4-(methoxymethoxy)phenyl]phenol has a molecular weight of 290.32 g/mol, XLogP of 3.02, 7 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 4-(methoxymethoxy)-3-[4-(methoxymethoxy)phenyl]phenol is sourced from PubChem (CID 71619534), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).