(2-bromophenyl)-pyridazin-3-ylmethanol

C11H9BrN2O — CID 21387711

IUPAC(2-bromophenyl)-pyridazin-3-ylmethanol
SMILESOC(c1cccnn1)c1ccccc1Br
InChIInChI=1S/C11H9BrN2O/c12-9-5-2-1-4-8(9)11(15)10-6-3-7-13-14-10/h1-7,11,15H
InChIKeyDFILCIUIYCYFGF-UHFFFAOYSA-N
MW265.11 g/mol
LogP2.32
Rot. Bonds2

About (2-bromophenyl)-pyridazin-3-ylmethanol

(2-bromophenyl)-pyridazin-3-ylmethanol (PubChem CID 21387711) has the molecular formula C11H9BrN2O and a molecular weight of 265.11 g/mol. Its IUPAC name is (2-bromophenyl)-pyridazin-3-ylmethanol.

Molecular Properties

Compound Name(2-bromophenyl)-pyridazin-3-ylmethanol
PubChem CID21387711
Molecular FormulaC11H9BrN2O
Molecular Weight265.11 g/mol
Exact Mass263.99
IUPAC Name(2-bromophenyl)-pyridazin-3-ylmethanol
SMILESOC(c1cccnn1)c1ccccc1Br
InChIInChI=1S/C11H9BrN2O/c12-9-5-2-1-4-8(9)11(15)10-6-3-7-13-14-10/h1-7,11,15H
InChIKeyDFILCIUIYCYFGF-UHFFFAOYSA-N
XLogP2.32
TPSA46.01 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds2
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500265.11
LogP ≤ 52.32
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

(+/-) 3-alpha-Hydroxybenzylpyridazine
CID 10397539
Phenyl(4-pyridazinyl)methanol
CID 13205669
3-(a-Methoxybenzyl)pyridazine
CID 15684250
1-Phenyl-1-pyridazin-3-ylethanol
CID 15684261
Diphenyl(pyridazin-3-yl)methanol
CID 10264686
(3-Bromo-2-fluorophenyl)(pyridazin-3-yl)methanol
CID 86730395
1-(4-Bromophenyl)-2,2,2-trifluoro-1-(5-methylpyridazin-3-yl)ethanol
CID 178113422
2-(3-Bromo-4-fluorophenyl)-1-pyridazin-4-ylethanol
CID 105082266
2-(3-Bromo-4-fluorophenyl)-1-(3,6-dimethylpyridazin-4-yl)ethanol
CID 105082287
2-(3-Bromo-4-fluorophenyl)-1-(3-ethyl-6-methylpyridazin-4-yl)ethanol
CID 105082309
2-(5-Bromo-2-fluorophenyl)-1-pyridazin-4-ylethanol
CID 105086547
2-(5-Bromo-2-fluorophenyl)-1-(3,6-dimethylpyridazin-4-yl)ethanol
CID 105086575

Frequently Asked Questions

What is the IUPAC name of (2-bromophenyl)-pyridazin-3-ylmethanol?
The IUPAC name of (2-bromophenyl)-pyridazin-3-ylmethanol (CID 21387711) is (2-bromophenyl)-pyridazin-3-ylmethanol.
What is the SMILES notation for (2-bromophenyl)-pyridazin-3-ylmethanol?
The canonical SMILES for (2-bromophenyl)-pyridazin-3-ylmethanol is OC(c1cccnn1)c1ccccc1Br.
What is the InChIKey of (2-bromophenyl)-pyridazin-3-ylmethanol?
The InChIKey is DFILCIUIYCYFGF-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H9BrN2O/c12-9-5-2-1-4-8(9)11(15)10-6-3-7-13-14-10/h1-7,11,15H.
What are the key properties of (2-bromophenyl)-pyridazin-3-ylmethanol?
(2-bromophenyl)-pyridazin-3-ylmethanol has a molecular weight of 265.11 g/mol, XLogP of 2.32, 2 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for (2-bromophenyl)-pyridazin-3-ylmethanol is sourced from PubChem (CID 21387711), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).