1-(2-chloro-5-phenylmethoxyphenyl)ethanol

C15H15ClO2 — CID 83988712

IUPAC1-(2-chloro-5-phenylmethoxyphenyl)ethanol
SMILESCC(O)c1cc(OCc2ccccc2)ccc1Cl
InChIInChI=1S/C15H15ClO2/c1-11(17)14-9-13(7-8-15(14)16)18-10-12-5-3-2-4-6-12/h2-9,11,17H,10H2,1H3
InChIKeyFOCZMLUJTZDLRF-UHFFFAOYSA-N
MW262.74 g/mol
LogP3.97
Rot. Bonds4

About 1-(2-chloro-5-phenylmethoxyphenyl)ethanol

1-(2-chloro-5-phenylmethoxyphenyl)ethanol (PubChem CID 83988712) has the molecular formula C15H15ClO2 and a molecular weight of 262.74 g/mol. Its IUPAC name is 1-(2-chloro-5-phenylmethoxyphenyl)ethanol.

Molecular Properties

Compound Name1-(2-chloro-5-phenylmethoxyphenyl)ethanol
PubChem CID83988712
Molecular FormulaC15H15ClO2
Molecular Weight262.74 g/mol
Exact Mass262.08
IUPAC Name1-(2-chloro-5-phenylmethoxyphenyl)ethanol
SMILESCC(O)c1cc(OCc2ccccc2)ccc1Cl
InChIInChI=1S/C15H15ClO2/c1-11(17)14-9-13(7-8-15(14)16)18-10-12-5-3-2-4-6-12/h2-9,11,17H,10H2,1H3
InChIKeyFOCZMLUJTZDLRF-UHFFFAOYSA-N
XLogP3.97
TPSA29.46 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds4
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500262.74
LogP ≤ 53.97
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

(1S)-1-(2-bromo-5-phenylmethoxyphenyl)ethanol
CID 171991585
1-butan-2-yl-2-chloro-4-phenylmethoxybenzene
CID 123587275
2-chloro-4-phenylmethoxy-1-propan-2-yloxybenzene
CID 50888763
2-chloro-1-(2-methylpropoxy)-4-phenylmethoxybenzene
CID 50888745
4-phenylmethoxy-2-propan-2-ylbenzoic acid
CID 23134235
1-(2-fluoro-5-phenylmethoxyphenyl)-2-phenylethanol
CID 83988743
1-(4-methyl-6-phenylmethoxy-3-pyridinyl)ethanol
CID 102545457
(1S,2R)-2-amino-1-(2-methyl-4-phenylmethoxyphenyl)propan-1-ol
CID 139820128
2-(2-chloro-4-phenylmethoxyphenyl)acetic acid
CID 4241746
(1S)-2-amino-1-(2-fluoro-5-phenylmethoxyphenyl)ethanol
CID 129361760
3-amino-3-(2-chloro-4-phenylmethoxyphenyl)propan-1-ol
CID 139696671
(1R)-1-[2-fluoro-4-(phenylmethoxymethoxy)phenyl]ethanol
CID 107720224

Frequently Asked Questions

What is the IUPAC name of 1-(2-chloro-5-phenylmethoxyphenyl)ethanol?
The IUPAC name of 1-(2-chloro-5-phenylmethoxyphenyl)ethanol (CID 83988712) is 1-(2-chloro-5-phenylmethoxyphenyl)ethanol.
What is the SMILES notation for 1-(2-chloro-5-phenylmethoxyphenyl)ethanol?
The canonical SMILES for 1-(2-chloro-5-phenylmethoxyphenyl)ethanol is CC(O)c1cc(OCc2ccccc2)ccc1Cl.
What is the InChIKey of 1-(2-chloro-5-phenylmethoxyphenyl)ethanol?
The InChIKey is FOCZMLUJTZDLRF-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H15ClO2/c1-11(17)14-9-13(7-8-15(14)16)18-10-12-5-3-2-4-6-12/h2-9,11,17H,10H2,1H3.
What are the key properties of 1-(2-chloro-5-phenylmethoxyphenyl)ethanol?
1-(2-chloro-5-phenylmethoxyphenyl)ethanol has a molecular weight of 262.74 g/mol, XLogP of 3.97, 4 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 1-(2-chloro-5-phenylmethoxyphenyl)ethanol is sourced from PubChem (CID 83988712), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).