Home Other Building Blocks 4-CHLOROTHIENO[3,2-C]PYRIDINE-7-CARBOXYLIC ACID

4-CHLOROTHIENO[3,2-C]PYRIDINE-7-CARBOXYLIC ACID

CAS No.:
55040-48-7
Catalog Number:
AG01EL7Y
Molecular Formula:
C8H4ClNO2S
Molecular Weight:
213.6409
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Product Description
Catalog Number:
AG01EL7Y
Chemical Name:
4-CHLOROTHIENO[3,2-C]PYRIDINE-7-CARBOXYLIC ACID
CAS Number:
55040-48-7
Molecular Formula:
C8H4ClNO2S
Molecular Weight:
213.6409
MDL Number:
MFCD18258728
IUPAC Name:
4-chlorothieno[3,2-c]pyridine-7-carboxylic acid
InChI:
InChI=1S/C8H4ClNO2S/c9-7-4-1-2-13-6(4)5(3-10-7)8(11)12/h1-3H,(H,11,12)
InChI Key:
WEIQRROBIJJLPF-UHFFFAOYSA-N
SMILES:
OC(=O)c1cnc(c2c1scc2)Cl
Properties
Complexity:
226  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
212.965g/mol
Formal Charge:
0
Heavy Atom Count:
13  
Hydrogen Bond Acceptor Count:
4  
Hydrogen Bond Donor Count:
1  
Isotope Atom Count:
0
Molecular Weight:
213.635g/mol
Monoisotopic Mass:
212.965g/mol
Rotatable Bond Count:
1  
Topological Polar Surface Area:
78.4A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
2.4  
Properties