2-(2-ethoxy-3-methoxyphenyl)-2-methylpropan-1-ol

C13H20O3 — CID 117322280

IUPAC2-(2-ethoxy-3-methoxyphenyl)-2-methylpropan-1-ol
SMILESCCOc1c(OC)cccc1C(C)(C)CO
InChIInChI=1S/C13H20O3/c1-5-16-12-10(13(2,3)9-14)7-6-8-11(12)15-4/h6-8,14H,5,9H2,1-4H3
InChIKeyGWHZJONSCVPNSV-UHFFFAOYSA-N
MW224.30 g/mol
LogP2.36
Rot. Bonds5

About 2-(2-ethoxy-3-methoxyphenyl)-2-methylpropan-1-ol

2-(2-ethoxy-3-methoxyphenyl)-2-methylpropan-1-ol (PubChem CID 117322280) has the molecular formula C13H20O3 and a molecular weight of 224.30 g/mol. Its IUPAC name is 2-(2-ethoxy-3-methoxyphenyl)-2-methylpropan-1-ol.

Molecular Properties

Compound Name2-(2-ethoxy-3-methoxyphenyl)-2-methylpropan-1-ol
PubChem CID117322280
Molecular FormulaC13H20O3
Molecular Weight224.30 g/mol
Exact Mass224.14
IUPAC Name2-(2-ethoxy-3-methoxyphenyl)-2-methylpropan-1-ol
SMILESCCOc1c(OC)cccc1C(C)(C)CO
InChIInChI=1S/C13H20O3/c1-5-16-12-10(13(2,3)9-14)7-6-8-11(12)15-4/h6-8,14H,5,9H2,1-4H3
InChIKeyGWHZJONSCVPNSV-UHFFFAOYSA-N
XLogP2.36
TPSA38.69 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds5
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500224.30
LogP ≤ 52.36
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

2-(2,3-diethoxyphenyl)propan-2-ol
CID 174362963
2-(6-bromo-2-ethoxy-3-methoxyphenyl)-2-methylpropan-1-ol
CID 117488224
2-amino-2-(2-ethoxy-3-methoxyphenyl)ethanol
CID 77130049
2-(5-ethoxy-2-methoxy-4-methylphenyl)-2-methylpropan-1-ol
CID 117349596
1,1-bis(2,3-dimethoxyphenyl)ethanol
CID 126607821
2-(5-methoxynaphthalen-1-yl)-2-methylpropan-1-amine
CID 105487005
2-ethoxy-3-methoxybenzoyl chloride
CID 21314777
methyl 2-ethoxy-3-methoxybenzoate
CID 45094190
1-(2-ethoxy-3-methoxyphenyl)propan-2-one
CID 13306100
(2S)-2-amino-2-(2-methoxyphenyl)propan-1-ol
CID 55277390
2-amino-3-(2-ethoxy-3-methoxyphenyl)propan-1-ol
CID 170893212
1-ethenyl-2-ethoxy-3-methoxybenzene
CID 11629687

Frequently Asked Questions

What is the IUPAC name of 2-(2-ethoxy-3-methoxyphenyl)-2-methylpropan-1-ol?
The IUPAC name of 2-(2-ethoxy-3-methoxyphenyl)-2-methylpropan-1-ol (CID 117322280) is 2-(2-ethoxy-3-methoxyphenyl)-2-methylpropan-1-ol.
What is the SMILES notation for 2-(2-ethoxy-3-methoxyphenyl)-2-methylpropan-1-ol?
The canonical SMILES for 2-(2-ethoxy-3-methoxyphenyl)-2-methylpropan-1-ol is CCOc1c(OC)cccc1C(C)(C)CO.
What is the InChIKey of 2-(2-ethoxy-3-methoxyphenyl)-2-methylpropan-1-ol?
The InChIKey is GWHZJONSCVPNSV-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H20O3/c1-5-16-12-10(13(2,3)9-14)7-6-8-11(12)15-4/h6-8,14H,5,9H2,1-4H3.
What are the key properties of 2-(2-ethoxy-3-methoxyphenyl)-2-methylpropan-1-ol?
2-(2-ethoxy-3-methoxyphenyl)-2-methylpropan-1-ol has a molecular weight of 224.30 g/mol, XLogP of 2.36, 5 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(2-ethoxy-3-methoxyphenyl)-2-methylpropan-1-ol is sourced from PubChem (CID 117322280), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).