(2-bromo-4-chlorophenyl)-(4-bromo-2,5-dimethoxyphenyl)methanol

C15H13Br2ClO3 — CID 107991354

IUPAC(2-bromo-4-chlorophenyl)-(4-bromo-2,5-dimethoxyphenyl)methanol
SMILESCOc1cc(C(O)c2ccc(Cl)cc2Br)c(OC)cc1Br
InChIInChI=1S/C15H13Br2ClO3/c1-20-13-7-12(17)14(21-2)6-10(13)15(19)9-4-3-8(18)5-11(9)16/h3-7,15,19H,1-2H3
InChIKeyUDZLNOYJMWHBRO-UHFFFAOYSA-N
MW436.53 g/mol
LogP4.96
Rot. Bonds4

About (2-bromo-4-chlorophenyl)-(4-bromo-2,5-dimethoxyphenyl)methanol

(2-bromo-4-chlorophenyl)-(4-bromo-2,5-dimethoxyphenyl)methanol (PubChem CID 107991354) has the molecular formula C15H13Br2ClO3 and a molecular weight of 436.53 g/mol. Its IUPAC name is (2-bromo-4-chlorophenyl)-(4-bromo-2,5-dimethoxyphenyl)methanol.

Molecular Properties

Compound Name(2-bromo-4-chlorophenyl)-(4-bromo-2,5-dimethoxyphenyl)methanol
PubChem CID107991354
Molecular FormulaC15H13Br2ClO3
Molecular Weight436.53 g/mol
Exact Mass433.89
IUPAC Name(2-bromo-4-chlorophenyl)-(4-bromo-2,5-dimethoxyphenyl)methanol
SMILESCOc1cc(C(O)c2ccc(Cl)cc2Br)c(OC)cc1Br
InChIInChI=1S/C15H13Br2ClO3/c1-20-13-7-12(17)14(21-2)6-10(13)15(19)9-4-3-8(18)5-11(9)16/h3-7,15,19H,1-2H3
InChIKeyUDZLNOYJMWHBRO-UHFFFAOYSA-N
XLogP4.96
TPSA38.69 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500436.53
LogP ≤ 54.96
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

(5-bromo-2-chlorophenyl)-(4-bromo-2,5-dimethoxyphenyl)methanol
CID 105057050
(4-bromo-2,5-dimethoxyphenyl)-(3-chloro-4-fluorophenyl)methanol
CID 105057040
(4-bromo-2,5-dimethoxyphenyl)-(2,3-dichlorophenyl)methanol
CID 105057027
1-bromo-2-[(2-bromo-4-chlorophenyl)-chloromethyl]-4,5-dimethoxybenzene
CID 107991493
(4-bromo-2,5-dimethoxyphenyl)-(3-chloro-2-methylphenyl)methanol
CID 107098959
(3-bromo-5-chlorophenyl)-(4-bromo-2,5-dimethoxyphenyl)methanol
CID 107955776
(4-bromo-2,5-dimethoxyphenyl)-(3-chloro-5-methylphenyl)methanol
CID 105057119
(4-bromo-2-chlorophenyl)-(2-bromo-4,5-dimethoxyphenyl)methanol
CID 61086660
(4-bromo-2,5-dimethoxyphenyl)-(4-methylthiophen-3-yl)methanol
CID 105057003
(4-bromo-2,5-dimethoxyphenyl)-(3-bromo-2-methylphenyl)methanol
CID 105056944
1-bromo-4-[bromo-(5-chloro-2-fluorophenyl)methyl]-2,5-dimethoxybenzene
CID 105057458
(2-bromo-4-chlorophenyl)-(5-bromo-2-ethoxyphenyl)methanol
CID 107991194

Frequently Asked Questions

What is the IUPAC name of (2-bromo-4-chlorophenyl)-(4-bromo-2,5-dimethoxyphenyl)methanol?
The IUPAC name of (2-bromo-4-chlorophenyl)-(4-bromo-2,5-dimethoxyphenyl)methanol (CID 107991354) is (2-bromo-4-chlorophenyl)-(4-bromo-2,5-dimethoxyphenyl)methanol.
What is the SMILES notation for (2-bromo-4-chlorophenyl)-(4-bromo-2,5-dimethoxyphenyl)methanol?
The canonical SMILES for (2-bromo-4-chlorophenyl)-(4-bromo-2,5-dimethoxyphenyl)methanol is COc1cc(C(O)c2ccc(Cl)cc2Br)c(OC)cc1Br.
What is the InChIKey of (2-bromo-4-chlorophenyl)-(4-bromo-2,5-dimethoxyphenyl)methanol?
The InChIKey is UDZLNOYJMWHBRO-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H13Br2ClO3/c1-20-13-7-12(17)14(21-2)6-10(13)15(19)9-4-3-8(18)5-11(9)16/h3-7,15,19H,1-2H3.
What are the key properties of (2-bromo-4-chlorophenyl)-(4-bromo-2,5-dimethoxyphenyl)methanol?
(2-bromo-4-chlorophenyl)-(4-bromo-2,5-dimethoxyphenyl)methanol has a molecular weight of 436.53 g/mol, XLogP of 4.96, 4 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for (2-bromo-4-chlorophenyl)-(4-bromo-2,5-dimethoxyphenyl)methanol is sourced from PubChem (CID 107991354), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).