(4-bromo-2-chlorophenyl)-(4-ethoxyphenyl)methanol

C15H14BrClO2 — CID 61101078

IUPAC(4-bromo-2-chlorophenyl)-(4-ethoxyphenyl)methanol
SMILESCCOc1ccc(C(O)c2ccc(Br)cc2Cl)cc1
InChIInChI=1S/C15H14BrClO2/c1-2-19-12-6-3-10(4-7-12)15(18)13-8-5-11(16)9-14(13)17/h3-9,15,18H,2H2,1H3
InChIKeyCYHWDAZVXUCODJ-UHFFFAOYSA-N
MW341.63 g/mol
LogP4.58
Rot. Bonds4

About (4-bromo-2-chlorophenyl)-(4-ethoxyphenyl)methanol

(4-bromo-2-chlorophenyl)-(4-ethoxyphenyl)methanol (PubChem CID 61101078) has the molecular formula C15H14BrClO2 and a molecular weight of 341.63 g/mol. Its IUPAC name is (4-bromo-2-chlorophenyl)-(4-ethoxyphenyl)methanol.

Molecular Properties

Compound Name(4-bromo-2-chlorophenyl)-(4-ethoxyphenyl)methanol
PubChem CID61101078
Molecular FormulaC15H14BrClO2
Molecular Weight341.63 g/mol
Exact Mass339.99
IUPAC Name(4-bromo-2-chlorophenyl)-(4-ethoxyphenyl)methanol
SMILESCCOc1ccc(C(O)c2ccc(Br)cc2Cl)cc1
InChIInChI=1S/C15H14BrClO2/c1-2-19-12-6-3-10(4-7-12)15(18)13-8-5-11(16)9-14(13)17/h3-9,15,18H,2H2,1H3
InChIKeyCYHWDAZVXUCODJ-UHFFFAOYSA-N
XLogP4.58
TPSA29.46 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds4
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500341.63
LogP ≤ 54.58
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

4-bromo-1-[bromo-(4-ethoxyphenyl)methyl]-2-chlorobenzene
CID 63437055
(4-bromo-2-chlorophenyl)-(3,4-diethylphenyl)methanol
CID 115482586
(3-bromophenyl)-(4-ethoxyphenyl)methanol
CID 46205463
(3,4-dichlorophenyl)-(4-ethoxyphenyl)methanol
CID 55133392
1-(5-bromo-2-chlorophenyl)-1-(4-ethoxyphenyl)-N-methylmethanamine
CID 43481853
(5-bromo-2-ethoxyphenyl)-(4-bromophenyl)methanol
CID 61081643
(2,6-dichlorophenyl)-(4-ethoxyphenyl)methanol
CID 61100563
(4-bromo-2-methoxyphenyl)-(2-chloro-4-methoxyphenyl)methanol
CID 115369750
(2-bromofuran-3-yl)-(4-ethoxyphenyl)methanol
CID 106855309
(3-bromo-4-methylphenyl)-(4-ethoxyphenyl)methanol
CID 81476153
4-bromo-1-[bromo-(4-ethoxyphenyl)methyl]-2-fluorobenzene
CID 55200086
(4-bromo-2-chlorophenyl)-(2-bromo-4,5-dimethoxyphenyl)methanol
CID 61086660

Frequently Asked Questions

What is the IUPAC name of (4-bromo-2-chlorophenyl)-(4-ethoxyphenyl)methanol?
The IUPAC name of (4-bromo-2-chlorophenyl)-(4-ethoxyphenyl)methanol (CID 61101078) is (4-bromo-2-chlorophenyl)-(4-ethoxyphenyl)methanol.
What is the SMILES notation for (4-bromo-2-chlorophenyl)-(4-ethoxyphenyl)methanol?
The canonical SMILES for (4-bromo-2-chlorophenyl)-(4-ethoxyphenyl)methanol is CCOc1ccc(C(O)c2ccc(Br)cc2Cl)cc1.
What is the InChIKey of (4-bromo-2-chlorophenyl)-(4-ethoxyphenyl)methanol?
The InChIKey is CYHWDAZVXUCODJ-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H14BrClO2/c1-2-19-12-6-3-10(4-7-12)15(18)13-8-5-11(16)9-14(13)17/h3-9,15,18H,2H2,1H3.
What are the key properties of (4-bromo-2-chlorophenyl)-(4-ethoxyphenyl)methanol?
(4-bromo-2-chlorophenyl)-(4-ethoxyphenyl)methanol has a molecular weight of 341.63 g/mol, XLogP of 4.58, 4 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for (4-bromo-2-chlorophenyl)-(4-ethoxyphenyl)methanol is sourced from PubChem (CID 61101078), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).