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Thieno[3,2-c]pyridine

CAT: 0127-OR30575-01Size: 100 mgDry Ice: NoHazardous: No
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CAT#:0127-OR30575-01Size:100 mg
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CAS Number
272-14-0
Synonyms
5-Aza-1-benzothiophene, 5-Azabenzo[b]thiophene
MDL Number
MFCD01760493
Purity
=95%
Smiles
C1cc2sccc2cn1
Storage Conditions
Store at 2-8°C

Chemical Information

Thieno(3,2-c)pyridine
CAS Number272-14-0
PubChem CID67500
IUPAC Namethieno[3,2-c]pyridine
Molecular FormulaC7H5NS
Molecular Weight135.19
XLogP1.9
Topological Polar Surface Area41.1
Hydrogen Bond Donor Count0
Hydrogen Bond Acceptor Count2
Rotatable Bond Count0
Heavy Atom Count9
Formal Charge0
Complexity105
SMILES
C1=CN=CC2=C1SC=C2
InChI
InChI=1S/C7H5NS/c1-3-8-5-6-2-4-9-7(1)6/h1-5H
InChIKey
MKYRMMMSZSVIGD-UHFFFAOYSA-N
Chemical Structure
2D Structure
2D structure of Thieno(3,2-c)pyridine
CAS: 272-14-0
CID: 67500
Formula: C7H5NS
MW: 135.19
Interactive 3D Structure
Loading 3D structure...
Computed Properties
PropertyValue
Molecular Weight135.19
XLogP31.9
Hydrogen Bond Donor Count0
Hydrogen Bond Acceptor Count2
Rotatable Bond Count0
Exact Mass135.01427034
Monoisotopic Mass135.01427034
Topological Polar Surface Area41.1 Ų
Heavy Atom Count9
Formal Charge0
Complexity105
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