1-[4-(4-bromophenoxy)phenyl]ethanol

C14H13BrO2 — CID 43506431

IUPAC1-[4-(4-bromophenoxy)phenyl]ethanol
SMILESCC(O)c1ccc(Oc2ccc(Br)cc2)cc1
InChIInChI=1S/C14H13BrO2/c1-10(16)11-2-6-13(7-3-11)17-14-8-4-12(15)5-9-14/h2-10,16H,1H3
InChIKeySFJUQOXPLWPNJH-UHFFFAOYSA-N
MW293.16 g/mol
LogP4.29
Rot. Bonds3

About 1-[4-(4-bromophenoxy)phenyl]ethanol

1-[4-(4-bromophenoxy)phenyl]ethanol (PubChem CID 43506431) has the molecular formula C14H13BrO2 and a molecular weight of 293.16 g/mol. Its IUPAC name is 1-[4-(4-bromophenoxy)phenyl]ethanol.

Molecular Properties

Compound Name1-[4-(4-bromophenoxy)phenyl]ethanol
PubChem CID43506431
Molecular FormulaC14H13BrO2
Molecular Weight293.16 g/mol
Exact Mass292.01
IUPAC Name1-[4-(4-bromophenoxy)phenyl]ethanol
SMILESCC(O)c1ccc(Oc2ccc(Br)cc2)cc1
InChIInChI=1S/C14H13BrO2/c1-10(16)11-2-6-13(7-3-11)17-14-8-4-12(15)5-9-14/h2-10,16H,1H3
InChIKeySFJUQOXPLWPNJH-UHFFFAOYSA-N
XLogP4.29
TPSA29.46 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500293.16
LogP ≤ 54.29
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

1'-Hydroxyestragole
CID 40003
1-(4-Methoxyphenyl)-1-propanol
CID 92218
1-Bromo-4-phenylmethoxybenzene
CID 138835
4-Ethoxybenzyl alcohol
CID 80345
(4-Phenoxyphenyl)methanol
CID 826195
1-Bromo-4-[(4-iodophenyl)methoxy]benzene
CID 65479031
(4-(Benzyloxy)phenyl)methanol
CID 70043
4-Methoxybenzhydryl alcohol
CID 95375
1-(4-Methoxyphenyl)ethanol
CID 101148
(1R)-1-(4-methoxyphenyl)ethan-1-ol
CID 641443
p,p'-Dimethoxybenzhydryl alcohol
CID 69768
1-(4-Methoxyphenyl)-2-phenylethanol
CID 223511

Frequently Asked Questions

What is the IUPAC name of 1-[4-(4-bromophenoxy)phenyl]ethanol?
The IUPAC name of 1-[4-(4-bromophenoxy)phenyl]ethanol (CID 43506431) is 1-[4-(4-bromophenoxy)phenyl]ethanol.
What is the SMILES notation for 1-[4-(4-bromophenoxy)phenyl]ethanol?
The canonical SMILES for 1-[4-(4-bromophenoxy)phenyl]ethanol is CC(O)c1ccc(Oc2ccc(Br)cc2)cc1.
What is the InChIKey of 1-[4-(4-bromophenoxy)phenyl]ethanol?
The InChIKey is SFJUQOXPLWPNJH-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H13BrO2/c1-10(16)11-2-6-13(7-3-11)17-14-8-4-12(15)5-9-14/h2-10,16H,1H3.
What are the key properties of 1-[4-(4-bromophenoxy)phenyl]ethanol?
1-[4-(4-bromophenoxy)phenyl]ethanol has a molecular weight of 293.16 g/mol, XLogP of 4.29, 3 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 1-[4-(4-bromophenoxy)phenyl]ethanol is sourced from PubChem (CID 43506431), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).