1-phenyl-2-(1-phenylethoxy)ethanol

C16H18O2 — CID 57324442

IUPAC1-phenyl-2-(1-phenylethoxy)ethanol
SMILESCC(OCC(O)c1ccccc1)c1ccccc1
InChIInChI=1S/C16H18O2/c1-13(14-8-4-2-5-9-14)18-12-16(17)15-10-6-3-7-11-15/h2-11,13,16-17H,12H2,1H3
InChIKeyCIXVZAKSVOFMDO-UHFFFAOYSA-N
MW242.32 g/mol
LogP3.50
Rot. Bonds5

About 1-phenyl-2-(1-phenylethoxy)ethanol

1-phenyl-2-(1-phenylethoxy)ethanol (PubChem CID 57324442) has the molecular formula C16H18O2 and a molecular weight of 242.32 g/mol. Its IUPAC name is 1-phenyl-2-(1-phenylethoxy)ethanol.

Molecular Properties

Compound Name1-phenyl-2-(1-phenylethoxy)ethanol
PubChem CID57324442
Molecular FormulaC16H18O2
Molecular Weight242.32 g/mol
Exact Mass242.13
IUPAC Name1-phenyl-2-(1-phenylethoxy)ethanol
SMILESCC(OCC(O)c1ccccc1)c1ccccc1
InChIInChI=1S/C16H18O2/c1-13(14-8-4-2-5-9-14)18-12-16(17)15-10-6-3-7-11-15/h2-11,13,16-17H,12H2,1H3
InChIKeyCIXVZAKSVOFMDO-UHFFFAOYSA-N
XLogP3.50
TPSA29.46 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds5
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500242.32
LogP ≤ 53.50
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

(1R)-2-[1-[3-(1-hydroxy-2-propan-2-yloxyethyl)phenyl]ethoxy]-1-phenylethanol
CID 155023348
benzene;2-methoxy-1-phenylethanol
CID 174622919
2-(1-ethoxypropan-2-yloxy)-1-phenylethanol
CID 103489701
2-pentan-2-yloxy-1-(4-phenylphenyl)ethanol
CID 102983372
1-(chloromethoxy)ethylbenzene
CID 13140582
methyl (2S)-2-amino-3-(1-phenylethoxy)propanoate
CID 67177747
(2-hydroxy-2-phenylethyl) hypochlorite;scandium
CID 155773445
1-(1-phenylethoxy)-3-[(2,2,3,3-tetramethylcyclopropyl)amino]propan-2-ol
CID 79352877
1-(2-methylanilino)-3-(1-phenylethoxy)propan-2-ol
CID 60902275
2-[[2-hydroxy-3-(1-phenylethoxy)propyl]amino]-3-methylbutan-1-ol
CID 79250235
1-(1-phenylethoxy)-3-(2,3,3-trimethylbutylamino)propan-2-ol
CID 83142673
1-(3-ethylpentan-2-ylamino)-3-(1-phenylethoxy)propan-2-ol
CID 63837243

Frequently Asked Questions

What is the IUPAC name of 1-phenyl-2-(1-phenylethoxy)ethanol?
The IUPAC name of 1-phenyl-2-(1-phenylethoxy)ethanol (CID 57324442) is 1-phenyl-2-(1-phenylethoxy)ethanol.
What is the SMILES notation for 1-phenyl-2-(1-phenylethoxy)ethanol?
The canonical SMILES for 1-phenyl-2-(1-phenylethoxy)ethanol is CC(OCC(O)c1ccccc1)c1ccccc1.
What is the InChIKey of 1-phenyl-2-(1-phenylethoxy)ethanol?
The InChIKey is CIXVZAKSVOFMDO-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H18O2/c1-13(14-8-4-2-5-9-14)18-12-16(17)15-10-6-3-7-11-15/h2-11,13,16-17H,12H2,1H3.
What are the key properties of 1-phenyl-2-(1-phenylethoxy)ethanol?
1-phenyl-2-(1-phenylethoxy)ethanol has a molecular weight of 242.32 g/mol, XLogP of 3.50, 5 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 1-phenyl-2-(1-phenylethoxy)ethanol is sourced from PubChem (CID 57324442), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).