2-Chlorothieno[2,3-b]pyridine

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CAS Number

1823943-95-8

Smiles

Clc1cc2c (s1) nccc2

Chemical Information

2-Chlorothieno[2,3-b]pyridine

CAS Number	1823943-95-8
PubChem CID	18689838
IUPAC Name	2-chlorothieno[2,3-b]pyridine
Molecular Formula	C7H4ClNS
Molecular Weight	169.63
XLogP	3.2
Topological Polar Surface Area	41.1
Hydrogen Bond Donor Count	0
Hydrogen Bond Acceptor Count	2
Rotatable Bond Count	0
Heavy Atom Count	10
Formal Charge	0
Complexity	131

SMILES

C1=CC2=C(N=C1)SC(=C2)Cl

InChI

InChI=1S/C7H4ClNS/c8-6-4-5-2-1-3-9-7(5)10-6/h1-4H

InChIKey

YFQGFTMIUMPCNY-UHFFFAOYSA-N

Chemical Structure

2D Structure

CAS: 1823943-95-8

CID: 18689838

Formula: C7H4ClNS

MW: 169.63

Interactive 3D Structure

Loading 3D structure...

Computed Properties

Property	Value
Molecular Weight	169.63
XLogP3	3.2
Hydrogen Bond Donor Count	0
Hydrogen Bond Acceptor Count	2
Rotatable Bond Count	0
Exact Mass	168.9752980
Monoisotopic Mass	168.9752980
Topological Polar Surface Area	41.1 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
OR88442-01	6-Chlorothieno[2,3-b]pyridine
OR510139-01	4-Chlorothieno[2,3-b]pyridine
OR923512-01	5-Chlorothieno[3,2-b]pyridine
OR20039-01	7-Chlorothieno[3,2-b]pyridine
OR1033546	7-Chlorothieno[3,2-b]pyridine oxalate
OR1066554-01	2-Bromo-6-chlorothieno[2,3-b]pyridine
OR92975-01	7-Chlorothieno[3,2-b]pyridine-2-carbaldehyde
OR91336	2-Bromo-7-chlorothieno[3,2-b]pyridine
OR1092170	7-Chlorothieno[3,2-b]pyridine-2-carbonitrile
OR1051639	6-Chlorothieno[2,3-b]pyridine-2-carbaldehyde

Catalog	Name
FC53344-01	7-Chlorothieno[3,2-B]Pyridine
abx182218-01	5-Chlorothieno[3,2-B]Pyridine
MCA22618-01	6-Chlorothieno[2,3-b]pyridine
JBD31298-01	5-Chlorothieno[3,2-b]pyridine-2-carbaldehyde
sc-259667	2-Bromo-6-chlorothieno[2,3-b]pyridine
AJA38505	2-Bromo-7-chlorothieno[3,2-b]pyridine
EFC29975-01	3-Chlorothieno[3,2-b]pyridine-2-carboxylic acid
MMB64024-01	3-Chlorothieno[2,3-b]pyridine-2-carboxylic acid
MLB33240-01	3-Bromo-5-chlorothieno[3,2-b]pyridine
WYA79357-01	7-chlorothieno[3,2-b]pyridine-2-carboxylic acid