1-(3-phenoxyphenyl)ethanol

C14H14O2 — CID 12882419

IUPAC1-(3-phenoxyphenyl)ethanol
SMILESCC(O)c1cccc(Oc2ccccc2)c1
InChIInChI=1S/C14H14O2/c1-11(15)12-6-5-9-14(10-12)16-13-7-3-2-4-8-13/h2-11,15H,1H3
InChIKeyMYWBBBSIAHHXJK-UHFFFAOYSA-N
MW214.26 g/mol
LogP3.53
Rot. Bonds3

About 1-(3-phenoxyphenyl)ethanol

1-(3-phenoxyphenyl)ethanol (PubChem CID 12882419) has the molecular formula C14H14O2 and a molecular weight of 214.26 g/mol. Its IUPAC name is 1-(3-phenoxyphenyl)ethanol.

Molecular Properties

Compound Name1-(3-phenoxyphenyl)ethanol
PubChem CID12882419
Molecular FormulaC14H14O2
Molecular Weight214.26 g/mol
Exact Mass214.10
IUPAC Name1-(3-phenoxyphenyl)ethanol
SMILESCC(O)c1cccc(Oc2ccccc2)c1
InChIInChI=1S/C14H14O2/c1-11(15)12-6-5-9-14(10-12)16-13-7-3-2-4-8-13/h2-11,15H,1H3
InChIKeyMYWBBBSIAHHXJK-UHFFFAOYSA-N
XLogP3.53
TPSA29.46 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500214.26
LogP ≤ 53.53
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

(2S,3R,4S)-4-(3-phenoxyphenyl)pentane-2,3-diol
CID 135050581
(1S,2R)-1-amino-1-(3-phenoxyphenyl)propan-2-ol
CID 171266953
3-methyl-1-(3-phenoxyphenyl)butan-1-ol
CID 63893717
(1R)-1-[3-(2-phenoxyethoxy)phenyl]ethanol
CID 63365536
(1R)-1-(3-methoxyphenyl)ethanol
CID 10219539
1-(4-phenoxyphenyl)ethanol;hydrochloride
CID 67663526
(1S)-1-(3-propan-2-yloxyphenyl)ethanol
CID 75358098
(2R)-2-(3-phenoxyphenyl)propanal
CID 92977533
(2S)-2-(3-phenoxyphenyl)propanenitrile
CID 90362403
1-[4-(3-methoxyphenoxy)phenyl]ethanol
CID 43506404
1,3-bis(3-propan-2-ylphenoxy)benzene
CID 90260311
(1R,2S)-1-amino-5-methyl-1-(3-phenoxyphenyl)hexan-2-ol
CID 171261271

Frequently Asked Questions

What is the IUPAC name of 1-(3-phenoxyphenyl)ethanol?
The IUPAC name of 1-(3-phenoxyphenyl)ethanol (CID 12882419) is 1-(3-phenoxyphenyl)ethanol.
What is the SMILES notation for 1-(3-phenoxyphenyl)ethanol?
The canonical SMILES for 1-(3-phenoxyphenyl)ethanol is CC(O)c1cccc(Oc2ccccc2)c1.
What is the InChIKey of 1-(3-phenoxyphenyl)ethanol?
The InChIKey is MYWBBBSIAHHXJK-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H14O2/c1-11(15)12-6-5-9-14(10-12)16-13-7-3-2-4-8-13/h2-11,15H,1H3.
What are the key properties of 1-(3-phenoxyphenyl)ethanol?
1-(3-phenoxyphenyl)ethanol has a molecular weight of 214.26 g/mol, XLogP of 3.53, 3 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 1-(3-phenoxyphenyl)ethanol is sourced from PubChem (CID 12882419), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).