2,5-Dichloronicotinaldehyde

CAT: 0024-sc-298640ASize: 5 gDry Ice: NoHazardous: No

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CAT#:0024-sc-298640ASize:5 g

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CAS Number

176433-49-1

Chemical Information

2,5-Dichloro-pyridine-3-carbaldehyde

CAS Number	176433-49-1
PubChem CID	21973274
IUPAC Name	2,5-dichloropyridine-3-carbaldehyde
Molecular Formula	C6H3Cl2NO
Molecular Weight	176.00
XLogP	1.9
Topological Polar Surface Area	30
Hydrogen Bond Donor Count	0
Hydrogen Bond Acceptor Count	2
Rotatable Bond Count	1
Heavy Atom Count	10
Formal Charge	0
Complexity	131

SMILES

C1=C(C=NC(=C1C=O)Cl)Cl

InChI

InChI=1S/C6H3Cl2NO/c7-5-1-4(3-10)6(8)9-2-5/h1-3H

InChIKey

IJHUAOWEHGGIRB-UHFFFAOYSA-N

Chemical Structure

2D Structure

CAS: 176433-49-1

CID: 21973274

Formula: C6H3Cl2NO

MW: 176.00

Interactive 3D Structure

Loading 3D structure...

Computed Properties

Property	Value
Molecular Weight	176.00
XLogP3	1.9
Hydrogen Bond Donor Count	0
Hydrogen Bond Acceptor Count	2
Rotatable Bond Count	1
Exact Mass	174.9591691
Monoisotopic Mass	174.9591691
Topological Polar Surface Area	30 Å²
Heavy Atom Count	10
Formal Charge	0
Complexity	131
Isotope Atom Count	0
Defined Atom Stereocenter Count	0
Undefined Atom Stereocenter Count	0
Defined Bond Stereocenter Count	0
Undefined Bond Stereocenter Count	0
Covalently-Bonded Unit Count	1
Compound Is Canonicalized	Yes

Catalog	Name
sc-227020	5,5''-Dibromo-2,2':5',2''-terthiophene
sc-477057	2,2':5',2''-Terthiophene-5,5''-dicarboxaldehyde
sc-474109	2,2′:5′,2′′:5′′,2′′′-Quaterthiophene
sc-265954	2,2',5,5'-Tetramethylbiphenyl
sc-475235	2,2',5,5'-Tetrachlorobenzidine
sc-481796	5''-Bromo-2,2:5',2''-terthiophene-5-carboxaldehyde
sc-476209	2,2':5',2''-Terthiophene-5-carboxaldehyde
sc-498855	2,5-Dihydro-3- (mercaptomethyl) -2,2,5,5-tetramethylpyrrol
sc-227018	5,5'-Dimethyl-2,2'-dipyridyl
sc-210388	5,5'-Dibromo-2,2-bithiophene

Catalog	Name
OR301386-01	2,5-Dichloronicotinaldehyde
OR303843-01	2,4-Dichloronicotinaldehyde
OR46107-01	2,6-Dichloronicotinaldehyde
OR1051592-01	2-Amino-4,6-dichloronicotinaldehyde
OR1051278-01	4-Amino-2,6-dichloronicotinaldehyde
OR303638-01	4,6-Dichloronicotinaldehyde
OR1079314	5,5'''-Dihexyl-2,2':5',2'':5'',2'''-quaterthiophene
OR1079313	5,5'''-Didecyl-2,2':5',2'':5'',2'''-quaterthiophene
OR1079310	5,5'''-Didodecyl-2,2':5',2'':5'',2'''-quaterthiophene
OR1042721-01	[2,2':5',2''-Terthiophene]-5,5''-dicarboxaldehyde