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2,3-Dichloro-5-Methylpyridine

CAT: 1299-RG-D020100-01Size: 10 mgDry Ice: NoHazardous: No
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CAT#:1299-RG-D020100-01Size:10 mg
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CAS Number
59782-90-0
Synonyms
2,3-dichloro-5-picoline
Molecular Formula
C6H5Cl2N
Molecular Weight
162.01
Product Name Synonym
2,3-dichloro-5-picoline

Chemical Information

2,3-Dichloro-5-methylpyridine
CAS Number59782-90-0
PubChem CID12747761
IUPAC Name2,3-dichloro-5-methylpyridine
Molecular FormulaC6H5Cl2N
Molecular Weight162.01
XLogP2.8
Topological Polar Surface Area12.9
Hydrogen Bond Donor Count0
Hydrogen Bond Acceptor Count1
Rotatable Bond Count0
Heavy Atom Count9
Formal Charge0
Complexity97
SMILES
CC1=CC(=C(N=C1)Cl)Cl
InChI
InChI=1S/C6H5Cl2N/c1-4-2-5(7)6(8)9-3-4/h2-3H,1H3
InChIKey
YZZGJHDTYZOSIH-UHFFFAOYSA-N
Chemical Structure
2D Structure
2D structure of 2,3-Dichloro-5-methylpyridine
CAS: 59782-90-0
CID: 12747761
Formula: C6H5Cl2N
MW: 162.01
Interactive 3D Structure
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View on PubChemRaw 3D data
Computed Properties
PropertyValue
Molecular Weight162.01
XLogP32.8
Hydrogen Bond Donor Count0
Hydrogen Bond Acceptor Count1
Rotatable Bond Count0
Exact Mass160.9799046
Monoisotopic Mass160.9799046
Topological Polar Surface Area12.9 Ų
Heavy Atom Count9
Formal Charge0
Complexity97.1
Isotope Atom Count0
Defined Atom Stereocenter Count0
Undefined Atom Stereocenter Count0
Defined Bond Stereocenter Count0
Undefined Bond Stereocenter Count0
Covalently-Bonded Unit Count1
Compound Is CanonicalizedYes

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CatalogName
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OR3151053,5-Dichloro-2-methylpyridine
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