2-phenoxy-1-(4-propylphenyl)ethanol

C17H20O2 — CID 54943234

IUPAC2-phenoxy-1-(4-propylphenyl)ethanol
SMILESCCCc1ccc(C(O)COc2ccccc2)cc1
InChIInChI=1S/C17H20O2/c1-2-6-14-9-11-15(12-10-14)17(18)13-19-16-7-4-3-5-8-16/h3-5,7-12,17-18H,2,6,13H2,1H3
InChIKeyLMYFPUAVYXOTLJ-UHFFFAOYSA-N
MW256.35 g/mol
LogP3.75
Rot. Bonds6

About 2-phenoxy-1-(4-propylphenyl)ethanol

2-phenoxy-1-(4-propylphenyl)ethanol (PubChem CID 54943234) has the molecular formula C17H20O2 and a molecular weight of 256.35 g/mol. Its IUPAC name is 2-phenoxy-1-(4-propylphenyl)ethanol.

Molecular Properties

Compound Name2-phenoxy-1-(4-propylphenyl)ethanol
PubChem CID54943234
Molecular FormulaC17H20O2
Molecular Weight256.35 g/mol
Exact Mass256.15
IUPAC Name2-phenoxy-1-(4-propylphenyl)ethanol
SMILESCCCc1ccc(C(O)COc2ccccc2)cc1
InChIInChI=1S/C17H20O2/c1-2-6-14-9-11-15(12-10-14)17(18)13-19-16-7-4-3-5-8-16/h3-5,7-12,17-18H,2,6,13H2,1H3
InChIKeyLMYFPUAVYXOTLJ-UHFFFAOYSA-N
XLogP3.75
TPSA29.46 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds6
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500256.35
LogP ≤ 53.75
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

3-phenoxy-1-(4-propylphenyl)propan-1-ol
CID 62802067
2-phenoxy-1-(3-propylphenyl)ethanol
CID 116543555
2-[4-(2-methoxyethyl)phenoxy]-1-phenylethanol
CID 60730618
2-(2,3-difluorophenoxy)-1-(4-propylphenyl)ethanol
CID 63037145
1-(2-methoxyphenyl)-2-(4-propylphenoxy)ethanol
CID 62549968
ethyl 3-[4-[(2R)-2-(cyclodecapentaenyl)-2-hydroxyethoxy]phenyl]propanoate
CID 144781228
[(2S)-2-hydroxy-3-(4-propylphenoxy)propyl]-[(1R)-1-phenylethyl]azanium
CID 6957345
2-(2,2-difluoroethoxy)-1-(4-propylphenyl)ethanol
CID 82007292
3-phenyl-1-(4-propoxyphenyl)propan-1-ol
CID 62795595
2-[4-(2-hydroxy-2-phenylethoxy)phenyl]acetonitrile
CID 60730786
(1S)-1-[4-(3-phenylpropoxy)phenyl]propan-1-ol
CID 78933443
1-(4-aminophenyl)-2-[4-(2-methoxyethyl)phenoxy]ethanol
CID 62266291

Frequently Asked Questions

What is the IUPAC name of 2-phenoxy-1-(4-propylphenyl)ethanol?
The IUPAC name of 2-phenoxy-1-(4-propylphenyl)ethanol (CID 54943234) is 2-phenoxy-1-(4-propylphenyl)ethanol.
What is the SMILES notation for 2-phenoxy-1-(4-propylphenyl)ethanol?
The canonical SMILES for 2-phenoxy-1-(4-propylphenyl)ethanol is CCCc1ccc(C(O)COc2ccccc2)cc1.
What is the InChIKey of 2-phenoxy-1-(4-propylphenyl)ethanol?
The InChIKey is LMYFPUAVYXOTLJ-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H20O2/c1-2-6-14-9-11-15(12-10-14)17(18)13-19-16-7-4-3-5-8-16/h3-5,7-12,17-18H,2,6,13H2,1H3.
What are the key properties of 2-phenoxy-1-(4-propylphenyl)ethanol?
2-phenoxy-1-(4-propylphenyl)ethanol has a molecular weight of 256.35 g/mol, XLogP of 3.75, 6 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2-phenoxy-1-(4-propylphenyl)ethanol is sourced from PubChem (CID 54943234), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).