(4-ethoxyphenyl)-methoxytin

C9H12O2Sn — CID 175724555

IUPAC(4-ethoxyphenyl)-methoxytin
SMILESCCOc1ccc([Sn]OC)cc1
InChIInChI=1S/C8H9O.CH3O.Sn/c1-2-9-8-6-4-3-5-7-8;1-2;/h4-7H,2H2,1H3;1H3;/q;-1;+1
InChIKeyUHYDJUSJNKYGHR-UHFFFAOYSA-N
MW270.90 g/mol
LogP0.98
Rot. Bonds4

About (4-ethoxyphenyl)-methoxytin

(4-ethoxyphenyl)-methoxytin (PubChem CID 175724555) has the molecular formula C9H12O2Sn and a molecular weight of 270.90 g/mol. Its IUPAC name is (4-ethoxyphenyl)-methoxytin.

Molecular Properties

Compound Name(4-ethoxyphenyl)-methoxytin
PubChem CID175724555
Molecular FormulaC9H12O2Sn
Molecular Weight270.90 g/mol
Exact Mass271.99
IUPAC Name(4-ethoxyphenyl)-methoxytin
SMILESCCOc1ccc([Sn]OC)cc1
InChIInChI=1S/C8H9O.CH3O.Sn/c1-2-9-8-6-4-3-5-7-8;1-2;/h4-7H,2H2,1H3;1H3;/q;-1;+1
InChIKeyUHYDJUSJNKYGHR-UHFFFAOYSA-N
XLogP0.98
TPSA18.46 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds4
Heavy Atoms12
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500270.90
LogP ≤ 50.98
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of (4-ethoxyphenyl)-methoxytin?
The IUPAC name of (4-ethoxyphenyl)-methoxytin (CID 175724555) is (4-ethoxyphenyl)-methoxytin.
What is the SMILES notation for (4-ethoxyphenyl)-methoxytin?
The canonical SMILES for (4-ethoxyphenyl)-methoxytin is CCOc1ccc([Sn]OC)cc1.
What is the InChIKey of (4-ethoxyphenyl)-methoxytin?
The InChIKey is UHYDJUSJNKYGHR-UHFFFAOYSA-N. The full InChI is InChI=1S/C8H9O.CH3O.Sn/c1-2-9-8-6-4-3-5-7-8;1-2;/h4-7H,2H2,1H3;1H3;/q;-1;+1.
What are the key properties of (4-ethoxyphenyl)-methoxytin?
(4-ethoxyphenyl)-methoxytin has a molecular weight of 270.90 g/mol, XLogP of 0.98, 4 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for (4-ethoxyphenyl)-methoxytin is sourced from PubChem (CID 175724555), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).