3-ethyl-2-(phenoxymethyl)phenol

C15H16O2 — CID 174805070

IUPAC3-ethyl-2-(phenoxymethyl)phenol
SMILESCCc1cccc(O)c1COc1ccccc1
InChIInChI=1S/C15H16O2/c1-2-12-7-6-10-15(16)14(12)11-17-13-8-4-3-5-9-13/h3-10,16H,2,11H2,1H3
InChIKeyVHKNSJHRSFTZBI-UHFFFAOYSA-N
MW228.29 g/mol
LogP3.53
Rot. Bonds4

About 3-ethyl-2-(phenoxymethyl)phenol

3-ethyl-2-(phenoxymethyl)phenol (PubChem CID 174805070) has the molecular formula C15H16O2 and a molecular weight of 228.29 g/mol. Its IUPAC name is 3-ethyl-2-(phenoxymethyl)phenol.

Molecular Properties

Compound Name3-ethyl-2-(phenoxymethyl)phenol
PubChem CID174805070
Molecular FormulaC15H16O2
Molecular Weight228.29 g/mol
Exact Mass228.12
IUPAC Name3-ethyl-2-(phenoxymethyl)phenol
SMILESCCc1cccc(O)c1COc1ccccc1
InChIInChI=1S/C15H16O2/c1-2-12-7-6-10-15(16)14(12)11-17-13-8-4-3-5-9-13/h3-10,16H,2,11H2,1H3
InChIKeyVHKNSJHRSFTZBI-UHFFFAOYSA-N
XLogP3.53
TPSA29.46 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds4
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500228.29
LogP ≤ 53.53
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

2,3-bis[(2-ethylphenoxy)methyl]phenol
CID 67177980
2-(aminomethyl)-3-ethylphenol
CID 21467751
2,3,4-triethyl-5-(phenoxymethyl)phenol
CID 151036486
2-[(2,4-diethylphenoxy)methyl]-3-ethylphenol
CID 122626793
3-ethyl-2-phenoxyphenol
CID 66865882
carbamic acid;2,3-diethylphenol;methanamine
CID 174684713
benzene;2-ethylphenol
CID 159726745
1,3,5-trimethyl-2,4,6-tris(phenoxymethyl)benzene
CID 139065941
6-(2,6-diethylphenyl)-2-methyl-3-(phenoxymethyl)-4-propan-2-yloxypyridine
CID 66995168
1-ethyl-2-[(3-methylphenoxy)methyl]benzene
CID 70995774
[3-ethyl-2-[(4-methylphenoxy)methyl]phenyl] propanoate
CID 122645766
ethyl 2-(phenoxymethyl)benzoate
CID 14674220

Frequently Asked Questions

What is the IUPAC name of 3-ethyl-2-(phenoxymethyl)phenol?
The IUPAC name of 3-ethyl-2-(phenoxymethyl)phenol (CID 174805070) is 3-ethyl-2-(phenoxymethyl)phenol.
What is the SMILES notation for 3-ethyl-2-(phenoxymethyl)phenol?
The canonical SMILES for 3-ethyl-2-(phenoxymethyl)phenol is CCc1cccc(O)c1COc1ccccc1.
What is the InChIKey of 3-ethyl-2-(phenoxymethyl)phenol?
The InChIKey is VHKNSJHRSFTZBI-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H16O2/c1-2-12-7-6-10-15(16)14(12)11-17-13-8-4-3-5-9-13/h3-10,16H,2,11H2,1H3.
What are the key properties of 3-ethyl-2-(phenoxymethyl)phenol?
3-ethyl-2-(phenoxymethyl)phenol has a molecular weight of 228.29 g/mol, XLogP of 3.53, 4 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 3-ethyl-2-(phenoxymethyl)phenol is sourced from PubChem (CID 174805070), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).