4-chloro-2,3-di(ethylidene)pyridine

C9H10ClN — CID 123324165

IUPAC4-chloro-2,3-di(ethylidene)pyridine
SMILESCC=c1nccc(Cl)c1=CC
InChIInChI=1S/C9H10ClN/c1-3-7-8(10)5-6-11-9(7)4-2/h3-6H,1-2H3
InChIKeyHTSAKQBXDSUJFC-UHFFFAOYSA-N
MW167.64 g/mol
LogP1.34
Rot. Bonds

About 4-chloro-2,3-di(ethylidene)pyridine

4-chloro-2,3-di(ethylidene)pyridine (PubChem CID 123324165) has the molecular formula C9H10ClN and a molecular weight of 167.64 g/mol. Its IUPAC name is 4-chloro-2,3-di(ethylidene)pyridine.

Molecular Properties

Compound Name4-chloro-2,3-di(ethylidene)pyridine
PubChem CID123324165
Molecular FormulaC9H10ClN
Molecular Weight167.64 g/mol
Exact Mass167.05
IUPAC Name4-chloro-2,3-di(ethylidene)pyridine
SMILESCC=c1nccc(Cl)c1=CC
InChIInChI=1S/C9H10ClN/c1-3-7-8(10)5-6-11-9(7)4-2/h3-6H,1-2H3
InChIKeyHTSAKQBXDSUJFC-UHFFFAOYSA-N
XLogP1.34
TPSA12.89 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds
Heavy Atoms11
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500167.64
LogP ≤ 51.34
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 101

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Frequently Asked Questions

What is the IUPAC name of 4-chloro-2,3-di(ethylidene)pyridine?
The IUPAC name of 4-chloro-2,3-di(ethylidene)pyridine (CID 123324165) is 4-chloro-2,3-di(ethylidene)pyridine.
What is the SMILES notation for 4-chloro-2,3-di(ethylidene)pyridine?
The canonical SMILES for 4-chloro-2,3-di(ethylidene)pyridine is CC=c1nccc(Cl)c1=CC.
What is the InChIKey of 4-chloro-2,3-di(ethylidene)pyridine?
The InChIKey is HTSAKQBXDSUJFC-UHFFFAOYSA-N. The full InChI is InChI=1S/C9H10ClN/c1-3-7-8(10)5-6-11-9(7)4-2/h3-6H,1-2H3.
What are the key properties of 4-chloro-2,3-di(ethylidene)pyridine?
4-chloro-2,3-di(ethylidene)pyridine has a molecular weight of 167.64 g/mol, XLogP of 1.34, 0 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 4-chloro-2,3-di(ethylidene)pyridine is sourced from PubChem (CID 123324165), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).