3-chloro-6-(2,5-dimethylphenoxy)pyridazine

C12H11ClN2O — CID 60675027

IUPAC3-chloro-6-(2,5-dimethylphenoxy)pyridazine
SMILESCc1ccc(C)c(Oc2ccc(Cl)nn2)c1
InChIInChI=1S/C12H11ClN2O/c1-8-3-4-9(2)10(7-8)16-12-6-5-11(13)14-15-12/h3-7H,1-2H3
InChIKeyRTCVXCKAPBLUEK-UHFFFAOYSA-N
MW234.69 g/mol
LogP3.54
Rot. Bonds2

About 3-chloro-6-(2,5-dimethylphenoxy)pyridazine

3-chloro-6-(2,5-dimethylphenoxy)pyridazine (PubChem CID 60675027) has the molecular formula C12H11ClN2O and a molecular weight of 234.69 g/mol. Its IUPAC name is 3-chloro-6-(2,5-dimethylphenoxy)pyridazine.

Molecular Properties

Compound Name3-chloro-6-(2,5-dimethylphenoxy)pyridazine
PubChem CID60675027
Molecular FormulaC12H11ClN2O
Molecular Weight234.69 g/mol
Exact Mass234.06
IUPAC Name3-chloro-6-(2,5-dimethylphenoxy)pyridazine
SMILESCc1ccc(C)c(Oc2ccc(Cl)nn2)c1
InChIInChI=1S/C12H11ClN2O/c1-8-3-4-9(2)10(7-8)16-12-6-5-11(13)14-15-12/h3-7H,1-2H3
InChIKeyRTCVXCKAPBLUEK-UHFFFAOYSA-N
XLogP3.54
TPSA35.01 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds2
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500234.69
LogP ≤ 53.54
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 103

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Related Compounds

Credazine
CID 26715
3-Chloro-6-(3-methoxyphenyl)pyridazine
CID 12726812
3,6-Bis(2-methylphenoxy)pyridazine
CID 2999999
Phosphorothioic acid, O-(6-(2-chloro-6-methylphenoxy)-3-pyridazinyl) O,O-diethyl ester
CID 198308
3-Chloro-6-(2-methoxyphenyl)pyridazine
CID 26370277
3-chloro-5H-chromeno(4,3-c)pyridazine
CID 14458431
2-[[3-(6-Chloropyridazin-3-yl)oxyphenyl]methylidene]propanedinitrile
CID 137764017
3-Fluoro-6-[(2-methoxyphenyl)methoxy]pyridazine
CID 139221071
3,6-Dichloro-4-(phenoxymethyl)pyridazine
CID 13755464
6-Chloro-3-pyridazinyl 3,4-difluorophenyl ether
CID 6403269
1-[4-[5-(6-chloropyridazin-3-yl)oxypentoxy]phenyl]-N-ethoxy-methanimine
CID 11820842
3-Chloro-6-(2,4-difluorophenoxy)pyridazine
CID 581464

Frequently Asked Questions

What is the IUPAC name of 3-chloro-6-(2,5-dimethylphenoxy)pyridazine?
The IUPAC name of 3-chloro-6-(2,5-dimethylphenoxy)pyridazine (CID 60675027) is 3-chloro-6-(2,5-dimethylphenoxy)pyridazine.
What is the SMILES notation for 3-chloro-6-(2,5-dimethylphenoxy)pyridazine?
The canonical SMILES for 3-chloro-6-(2,5-dimethylphenoxy)pyridazine is Cc1ccc(C)c(Oc2ccc(Cl)nn2)c1.
What is the InChIKey of 3-chloro-6-(2,5-dimethylphenoxy)pyridazine?
The InChIKey is RTCVXCKAPBLUEK-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H11ClN2O/c1-8-3-4-9(2)10(7-8)16-12-6-5-11(13)14-15-12/h3-7H,1-2H3.
What are the key properties of 3-chloro-6-(2,5-dimethylphenoxy)pyridazine?
3-chloro-6-(2,5-dimethylphenoxy)pyridazine has a molecular weight of 234.69 g/mol, XLogP of 3.54, 2 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 3-chloro-6-(2,5-dimethylphenoxy)pyridazine is sourced from PubChem (CID 60675027), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).