2-methoxy-2-(4-methoxyphenyl)propan-1-ol

C11H16O3 — CID 105449931

IUPAC2-methoxy-2-(4-methoxyphenyl)propan-1-ol
SMILESCOc1ccc(C(C)(CO)OC)cc1
InChIInChI=1S/C11H16O3/c1-11(8-12,14-3)9-4-6-10(13-2)7-5-9/h4-7,12H,8H2,1-3H3
InChIKeyZXZBGUYVZICBAZ-UHFFFAOYSA-N
MW196.25 g/mol
LogP1.55
Rot. Bonds4

About 2-methoxy-2-(4-methoxyphenyl)propan-1-ol

2-methoxy-2-(4-methoxyphenyl)propan-1-ol (PubChem CID 105449931) has the molecular formula C11H16O3 and a molecular weight of 196.25 g/mol. Its IUPAC name is 2-methoxy-2-(4-methoxyphenyl)propan-1-ol.

Molecular Properties

Compound Name2-methoxy-2-(4-methoxyphenyl)propan-1-ol
PubChem CID105449931
Molecular FormulaC11H16O3
Molecular Weight196.25 g/mol
Exact Mass196.11
IUPAC Name2-methoxy-2-(4-methoxyphenyl)propan-1-ol
SMILESCOc1ccc(C(C)(CO)OC)cc1
InChIInChI=1S/C11H16O3/c1-11(8-12,14-3)9-4-6-10(13-2)7-5-9/h4-7,12H,8H2,1-3H3
InChIKeyZXZBGUYVZICBAZ-UHFFFAOYSA-N
XLogP1.55
TPSA38.69 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms14
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500196.25
LogP ≤ 51.55
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of 2-methoxy-2-(4-methoxyphenyl)propan-1-ol?
The IUPAC name of 2-methoxy-2-(4-methoxyphenyl)propan-1-ol (CID 105449931) is 2-methoxy-2-(4-methoxyphenyl)propan-1-ol.
What is the SMILES notation for 2-methoxy-2-(4-methoxyphenyl)propan-1-ol?
The canonical SMILES for 2-methoxy-2-(4-methoxyphenyl)propan-1-ol is COc1ccc(C(C)(CO)OC)cc1.
What is the InChIKey of 2-methoxy-2-(4-methoxyphenyl)propan-1-ol?
The InChIKey is ZXZBGUYVZICBAZ-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H16O3/c1-11(8-12,14-3)9-4-6-10(13-2)7-5-9/h4-7,12H,8H2,1-3H3.
What are the key properties of 2-methoxy-2-(4-methoxyphenyl)propan-1-ol?
2-methoxy-2-(4-methoxyphenyl)propan-1-ol has a molecular weight of 196.25 g/mol, XLogP of 1.55, 4 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-methoxy-2-(4-methoxyphenyl)propan-1-ol is sourced from PubChem (CID 105449931), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).