formyl chloride;2-phenylpyridine

C12H10ClNO — CID 175066008

IUPACformyl chloride;2-phenylpyridine
SMILESO=CCl.c1ccc(-c2ccccn2)cc1
InChIInChI=1S/C11H9N.CHClO/c1-2-6-10(7-3-1)11-8-4-5-9-12-11;2-1-3/h1-9H;1H
InChIKeyLCLVWTNHTSJJGM-UHFFFAOYSA-N
MW219.67 g/mol
LogP3.16
Rot. Bonds1

About formyl chloride;2-phenylpyridine

formyl chloride;2-phenylpyridine (PubChem CID 175066008) has the molecular formula C12H10ClNO and a molecular weight of 219.67 g/mol. Its IUPAC name is formyl chloride;2-phenylpyridine.

Molecular Properties

Compound Nameformyl chloride;2-phenylpyridine
PubChem CID175066008
Molecular FormulaC12H10ClNO
Molecular Weight219.67 g/mol
Exact Mass219.05
IUPAC Nameformyl chloride;2-phenylpyridine
SMILESO=CCl.c1ccc(-c2ccccn2)cc1
InChIInChI=1S/C11H9N.CHClO/c1-2-6-10(7-3-1)11-8-4-5-9-12-11;2-1-3/h1-9H;1H
InChIKeyLCLVWTNHTSJJGM-UHFFFAOYSA-N
XLogP3.16
TPSA29.96 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds1
Heavy Atoms15
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500219.67
LogP ≤ 53.16
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'acid_halide', 'substructure': 'N/A'}, {'alert_name': 'aldehyde', 'substructure': 'N/A'}

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Frequently Asked Questions

What is the IUPAC name of formyl chloride;2-phenylpyridine?
The IUPAC name of formyl chloride;2-phenylpyridine (CID 175066008) is formyl chloride;2-phenylpyridine.
What is the SMILES notation for formyl chloride;2-phenylpyridine?
The canonical SMILES for formyl chloride;2-phenylpyridine is O=CCl.c1ccc(-c2ccccn2)cc1.
What is the InChIKey of formyl chloride;2-phenylpyridine?
The InChIKey is LCLVWTNHTSJJGM-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H9N.CHClO/c1-2-6-10(7-3-1)11-8-4-5-9-12-11;2-1-3/h1-9H;1H.
What are the key properties of formyl chloride;2-phenylpyridine?
formyl chloride;2-phenylpyridine has a molecular weight of 219.67 g/mol, XLogP of 3.16, 1 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for formyl chloride;2-phenylpyridine is sourced from PubChem (CID 175066008), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).