(5-bromo-2-ethoxyphenyl)-(3-bromophenyl)methanol

C15H14Br2O2 — CID 61082247

IUPAC(5-bromo-2-ethoxyphenyl)-(3-bromophenyl)methanol
SMILESCCOc1ccc(Br)cc1C(O)c1cccc(Br)c1
InChIInChI=1S/C15H14Br2O2/c1-2-19-14-7-6-12(17)9-13(14)15(18)10-4-3-5-11(16)8-10/h3-9,15,18H,2H2,1H3
InChIKeyFZRZEHIWWZGMFD-UHFFFAOYSA-N
MW386.08 g/mol
LogP4.69
Rot. Bonds4

About (5-bromo-2-ethoxyphenyl)-(3-bromophenyl)methanol

(5-bromo-2-ethoxyphenyl)-(3-bromophenyl)methanol (PubChem CID 61082247) has the molecular formula C15H14Br2O2 and a molecular weight of 386.08 g/mol. Its IUPAC name is (5-bromo-2-ethoxyphenyl)-(3-bromophenyl)methanol.

Molecular Properties

Compound Name(5-bromo-2-ethoxyphenyl)-(3-bromophenyl)methanol
PubChem CID61082247
Molecular FormulaC15H14Br2O2
Molecular Weight386.08 g/mol
Exact Mass383.94
IUPAC Name(5-bromo-2-ethoxyphenyl)-(3-bromophenyl)methanol
SMILESCCOc1ccc(Br)cc1C(O)c1cccc(Br)c1
InChIInChI=1S/C15H14Br2O2/c1-2-19-14-7-6-12(17)9-13(14)15(18)10-4-3-5-11(16)8-10/h3-9,15,18H,2H2,1H3
InChIKeyFZRZEHIWWZGMFD-UHFFFAOYSA-N
XLogP4.69
TPSA29.46 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds4
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500386.08
LogP ≤ 54.69
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

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CID 107980915
3-amino-2-(3-bromophenyl)-1-(2-ethoxyphenyl)propan-1-ol
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(3-bromophenyl)-(2-ethylphenyl)methanol
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(2-ethoxy-5-methylphenyl)-(3-fluorophenyl)methanol
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(2-bromo-4-chlorophenyl)-(5-bromo-2-ethoxyphenyl)methanol
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(5-bromo-2-ethoxyphenyl)-(2,4-difluorophenyl)methanol
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Frequently Asked Questions

What is the IUPAC name of (5-bromo-2-ethoxyphenyl)-(3-bromophenyl)methanol?
The IUPAC name of (5-bromo-2-ethoxyphenyl)-(3-bromophenyl)methanol (CID 61082247) is (5-bromo-2-ethoxyphenyl)-(3-bromophenyl)methanol.
What is the SMILES notation for (5-bromo-2-ethoxyphenyl)-(3-bromophenyl)methanol?
The canonical SMILES for (5-bromo-2-ethoxyphenyl)-(3-bromophenyl)methanol is CCOc1ccc(Br)cc1C(O)c1cccc(Br)c1.
What is the InChIKey of (5-bromo-2-ethoxyphenyl)-(3-bromophenyl)methanol?
The InChIKey is FZRZEHIWWZGMFD-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H14Br2O2/c1-2-19-14-7-6-12(17)9-13(14)15(18)10-4-3-5-11(16)8-10/h3-9,15,18H,2H2,1H3.
What are the key properties of (5-bromo-2-ethoxyphenyl)-(3-bromophenyl)methanol?
(5-bromo-2-ethoxyphenyl)-(3-bromophenyl)methanol has a molecular weight of 386.08 g/mol, XLogP of 4.69, 4 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for (5-bromo-2-ethoxyphenyl)-(3-bromophenyl)methanol is sourced from PubChem (CID 61082247), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).