(4-bromophenyl)-(3-methoxyphenyl)methanol

C14H13BrO2 — CID 18507125

IUPAC(4-bromophenyl)-(3-methoxyphenyl)methanol
SMILESCOc1cccc(C(O)c2ccc(Br)cc2)c1
InChIInChI=1S/C14H13BrO2/c1-17-13-4-2-3-11(9-13)14(16)10-5-7-12(15)8-6-10/h2-9,14,16H,1H3
InChIKeyRUJMKPWOXLACAZ-UHFFFAOYSA-N
MW293.16 g/mol
LogP3.54
Rot. Bonds3

About (4-bromophenyl)-(3-methoxyphenyl)methanol

(4-bromophenyl)-(3-methoxyphenyl)methanol (PubChem CID 18507125) has the molecular formula C14H13BrO2 and a molecular weight of 293.16 g/mol. Its IUPAC name is (4-bromophenyl)-(3-methoxyphenyl)methanol.

Molecular Properties

Compound Name(4-bromophenyl)-(3-methoxyphenyl)methanol
PubChem CID18507125
Molecular FormulaC14H13BrO2
Molecular Weight293.16 g/mol
Exact Mass292.01
IUPAC Name(4-bromophenyl)-(3-methoxyphenyl)methanol
SMILESCOc1cccc(C(O)c2ccc(Br)cc2)c1
InChIInChI=1S/C14H13BrO2/c1-17-13-4-2-3-11(9-13)14(16)10-5-7-12(15)8-6-10/h2-9,14,16H,1H3
InChIKeyRUJMKPWOXLACAZ-UHFFFAOYSA-N
XLogP3.54
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 ≤ 53.54
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of (4-bromophenyl)-(3-methoxyphenyl)methanol?
The IUPAC name of (4-bromophenyl)-(3-methoxyphenyl)methanol (CID 18507125) is (4-bromophenyl)-(3-methoxyphenyl)methanol.
What is the SMILES notation for (4-bromophenyl)-(3-methoxyphenyl)methanol?
The canonical SMILES for (4-bromophenyl)-(3-methoxyphenyl)methanol is COc1cccc(C(O)c2ccc(Br)cc2)c1.
What is the InChIKey of (4-bromophenyl)-(3-methoxyphenyl)methanol?
The InChIKey is RUJMKPWOXLACAZ-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H13BrO2/c1-17-13-4-2-3-11(9-13)14(16)10-5-7-12(15)8-6-10/h2-9,14,16H,1H3.
What are the key properties of (4-bromophenyl)-(3-methoxyphenyl)methanol?
(4-bromophenyl)-(3-methoxyphenyl)methanol has a molecular weight of 293.16 g/mol, XLogP of 3.54, 3 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for (4-bromophenyl)-(3-methoxyphenyl)methanol is sourced from PubChem (CID 18507125), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).