1-[2-[(3-bromophenyl)methoxy]phenyl]ethanol

C15H15BrO2 — CID 43504021

IUPAC1-[2-[(3-bromophenyl)methoxy]phenyl]ethanol
SMILESCC(O)c1ccccc1OCc1cccc(Br)c1
InChIInChI=1S/C15H15BrO2/c1-11(17)14-7-2-3-8-15(14)18-10-12-5-4-6-13(16)9-12/h2-9,11,17H,10H2,1H3
InChIKeyWGSDMEIBPDTOEL-UHFFFAOYSA-N
MW307.19 g/mol
LogP4.08
Rot. Bonds4

About 1-[2-[(3-bromophenyl)methoxy]phenyl]ethanol

1-[2-[(3-bromophenyl)methoxy]phenyl]ethanol (PubChem CID 43504021) has the molecular formula C15H15BrO2 and a molecular weight of 307.19 g/mol. Its IUPAC name is 1-[2-[(3-bromophenyl)methoxy]phenyl]ethanol.

Molecular Properties

Compound Name1-[2-[(3-bromophenyl)methoxy]phenyl]ethanol
PubChem CID43504021
Molecular FormulaC15H15BrO2
Molecular Weight307.19 g/mol
Exact Mass306.03
IUPAC Name1-[2-[(3-bromophenyl)methoxy]phenyl]ethanol
SMILESCC(O)c1ccccc1OCc1cccc(Br)c1
InChIInChI=1S/C15H15BrO2/c1-11(17)14-7-2-3-8-15(14)18-10-12-5-4-6-13(16)9-12/h2-9,11,17H,10H2,1H3
InChIKeyWGSDMEIBPDTOEL-UHFFFAOYSA-N
XLogP4.08
TPSA29.46 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds4
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500307.19
LogP ≤ 54.08
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

1-[2-[(3-bromophenyl)methoxy]-4-methylphenyl]ethanol
CID 63651626
(1S)-1-[2-[(3-bromophenyl)methoxy]-5-methylphenyl]ethanol
CID 78933642
(1R)-1-(5-bromo-2-phenylmethoxyphenyl)ethanol
CID 78932268
1-[2-[(3-bromophenyl)methoxy]phenyl]propan-1-amine
CID 60879213
(1R)-1-[2-[(3-bromo-4-methoxyphenyl)methoxy]phenyl]ethanol
CID 63364819
1-[2-[[3-(trifluoromethyl)phenyl]methoxy]phenyl]ethanol
CID 43503898
1-[2-[(3-nitrophenyl)methoxy]phenyl]ethanol
CID 43503886
(1R)-1-[5-bromo-2-[(3-methoxyphenyl)methoxy]phenyl]ethanol
CID 63365872
(1S)-1-[5-bromo-2-[(3-methoxyphenyl)methoxy]phenyl]ethanol
CID 78932276
(1S)-1-[2-[(3,4-difluorophenyl)methoxy]phenyl]ethanol
CID 82918200
(1S)-1-[2-[(3,4-dimethoxyphenyl)methoxy]phenyl]ethanol
CID 63364724
1-[2-[(4-methylphenyl)methoxy]phenyl]ethanol
CID 43504033

Frequently Asked Questions

What is the IUPAC name of 1-[2-[(3-bromophenyl)methoxy]phenyl]ethanol?
The IUPAC name of 1-[2-[(3-bromophenyl)methoxy]phenyl]ethanol (CID 43504021) is 1-[2-[(3-bromophenyl)methoxy]phenyl]ethanol.
What is the SMILES notation for 1-[2-[(3-bromophenyl)methoxy]phenyl]ethanol?
The canonical SMILES for 1-[2-[(3-bromophenyl)methoxy]phenyl]ethanol is CC(O)c1ccccc1OCc1cccc(Br)c1.
What is the InChIKey of 1-[2-[(3-bromophenyl)methoxy]phenyl]ethanol?
The InChIKey is WGSDMEIBPDTOEL-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H15BrO2/c1-11(17)14-7-2-3-8-15(14)18-10-12-5-4-6-13(16)9-12/h2-9,11,17H,10H2,1H3.
What are the key properties of 1-[2-[(3-bromophenyl)methoxy]phenyl]ethanol?
1-[2-[(3-bromophenyl)methoxy]phenyl]ethanol has a molecular weight of 307.19 g/mol, XLogP of 4.08, 4 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 1-[2-[(3-bromophenyl)methoxy]phenyl]ethanol is sourced from PubChem (CID 43504021), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).