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4-(5-Methyl-1,2,4-oxadiazol-3-yl)benzoyl Chloride

4-(5-Methyl-1,2,4-oxadiazol-3-yl)benzoyl Chloride - CAS 222541-76-6

Catalog:	BB017476
Product Name:	4-(5-Methyl-1,2,4-oxadiazol-3-yl)benzoyl Chloride
CAS:	222541-76-6
Synonyms:	4-(5-methyl-1,2,4-oxadiazol-3-yl)benzoyl chloride; 4-(5-methyl-1,2,4-oxadiazol-3-yl)benzoyl chloride

Technical Data

Patents

Computed Properties

IUPAC Name:	4-(5-methyl-1,2,4-oxadiazol-3-yl)benzoyl chloride
Description:	4-(5-Methyl-1,2,4-oxadiazol-3-yl)benzoyl Chloride (CAS# 222541-76-6) is a useful research chemical.
Molecular Weight:	222.63
Molecular Formula:	C10H7ClN2O2
Canonical SMILES:	CC1=NC(=NO1)C2=CC=C(C=C2)C(=O)Cl
InChI:	InChI=1S/C10H7ClN2O2/c1-6-12-10(13-15-6)8-4-2-7(3-5-8)9(11)14/h2-5H,1H3
InChI Key:	SMBDBBBBXFXBSK-UHFFFAOYSA-N
Boiling Point:	361.4 °C at 760 mmHg
Density:	1.335 g/cm³
LogP:	2.42400

Publication Number	Title	Priority Date
EP-2094677-A1	Thiadiazole derivatives for the treatment of neuro-degenerative diseases	20061122
EP-2094677-B1	Thiadiazole derivatives for the treatment of neuro-degenerative diseases	20061122
ES-2359104-T3	TIADIAZOL DERIVATIVES FOR THE TREATMENT OF NEURODEGENERATIVE DISEASES.	20061122
US-2010144709-A1	Thiadiazole derivatives for the treatment of neuro-degenerative diseases	20061122
US-7960556-B2	Thiadiazole derivatives for the treatment of neuro-degenerative diseases	20061122

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Complexity:	242
Compound Is Canonicalized:	Yes
Covalently-Bonded Unit Count:	1
Defined Atom Stereocenter Count:	0
Defined Bond Stereocenter Count:	0
Exact Mass:	222.0196052
Formal Charge:	0
Heavy Atom Count:	15
Hydrogen Bond Acceptor Count:	4
Hydrogen Bond Donor Count:	0
Isotope Atom Count:	0
Monoisotopic Mass:	222.0196052
Rotatable Bond Count:	2
Topological Polar Surface Area:	56
Undefined Atom Stereocenter Count:	0
Undefined Bond Stereocenter Count:	0
XLogP3:	2.9