3-ethoxy-2-(2-methylphenyl)propan-1-ol

C12H18O2 — CID 103985037

IUPAC3-ethoxy-2-(2-methylphenyl)propan-1-ol
SMILESCCOCC(CO)c1ccccc1C
InChIInChI=1S/C12H18O2/c1-3-14-9-11(8-13)12-7-5-4-6-10(12)2/h4-7,11,13H,3,8-9H2,1-2H3
InChIKeyVFUDNMQAYPCJTO-UHFFFAOYSA-N
MW194.27 g/mol
LogP2.11
Rot. Bonds5

About 3-ethoxy-2-(2-methylphenyl)propan-1-ol

3-ethoxy-2-(2-methylphenyl)propan-1-ol (PubChem CID 103985037) has the molecular formula C12H18O2 and a molecular weight of 194.27 g/mol. Its IUPAC name is 3-ethoxy-2-(2-methylphenyl)propan-1-ol.

Molecular Properties

Compound Name3-ethoxy-2-(2-methylphenyl)propan-1-ol
PubChem CID103985037
Molecular FormulaC12H18O2
Molecular Weight194.27 g/mol
Exact Mass194.13
IUPAC Name3-ethoxy-2-(2-methylphenyl)propan-1-ol
SMILESCCOCC(CO)c1ccccc1C
InChIInChI=1S/C12H18O2/c1-3-14-9-11(8-13)12-7-5-4-6-10(12)2/h4-7,11,13H,3,8-9H2,1-2H3
InChIKeyVFUDNMQAYPCJTO-UHFFFAOYSA-N
XLogP2.11
TPSA29.46 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds5
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500194.27
LogP ≤ 52.11
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

3-hydrazinyl-2-(2-methylphenyl)propan-1-ol
CID 105438798
1-(1-chloro-3-phenylmethoxypropan-2-yl)-2-methylbenzene
CID 102940982
4-ethoxy-N-methyl-2-(2-methylphenyl)butan-1-amine
CID 79421089
3-(5-ethylthiophen-2-yl)-2-(2-methylphenyl)propan-1-ol
CID 79424431
3-(3,4-dichlorophenyl)-2-(2-methylphenyl)propan-1-ol
CID 79421828
1-(2-methylphenyl)-2-(2-propoxyethoxy)ethanol
CID 55233858
(2S)-2-(4-bromo-2-methylphenyl)-3-phenylmethoxypropan-1-ol
CID 118092700
1-(1-bromo-3-phenylmethoxypropan-2-yl)-2-methylbenzene
CID 102940983
4-ethoxy-2-(2-methylphenyl)-N-propylbutan-1-amine
CID 79421267
1-(2-bromo-3-methylphenyl)-2-ethoxyethanamine
CID 107985181
1-(2-methylphenyl)-1-phenylpentan-3-one
CID 102348296
N-methyl-2-(2-methylphenyl)-3-phenylmethoxypropan-1-amine
CID 102940569

Frequently Asked Questions

What is the IUPAC name of 3-ethoxy-2-(2-methylphenyl)propan-1-ol?
The IUPAC name of 3-ethoxy-2-(2-methylphenyl)propan-1-ol (CID 103985037) is 3-ethoxy-2-(2-methylphenyl)propan-1-ol.
What is the SMILES notation for 3-ethoxy-2-(2-methylphenyl)propan-1-ol?
The canonical SMILES for 3-ethoxy-2-(2-methylphenyl)propan-1-ol is CCOCC(CO)c1ccccc1C.
What is the InChIKey of 3-ethoxy-2-(2-methylphenyl)propan-1-ol?
The InChIKey is VFUDNMQAYPCJTO-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H18O2/c1-3-14-9-11(8-13)12-7-5-4-6-10(12)2/h4-7,11,13H,3,8-9H2,1-2H3.
What are the key properties of 3-ethoxy-2-(2-methylphenyl)propan-1-ol?
3-ethoxy-2-(2-methylphenyl)propan-1-ol has a molecular weight of 194.27 g/mol, XLogP of 2.11, 5 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 3-ethoxy-2-(2-methylphenyl)propan-1-ol is sourced from PubChem (CID 103985037), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).