Home Carboxys 3-BroMothieno[2,3-b]pyridine-2-carboxylic acid

3-BroMothieno[2,3-b]pyridine-2-carboxylic acid

CAS No.:
72832-25-8
Catalog Number:
AG00FH1Y
Molecular Formula:
C8H4BrNO2S
Molecular Weight:
258.0919
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Product Description
Catalog Number:
AG00FH1Y
Chemical Name:
3-BroMothieno[2,3-b]pyridine-2-carboxylic acid
CAS Number:
72832-25-8
Molecular Formula:
C8H4BrNO2S
Molecular Weight:
258.0919
MDL Number:
MFCD13193587
IUPAC Name:
3-bromothieno[2,3-b]pyridine-2-carboxylic acid
InChI:
InChI=1S/C8H4BrNO2S/c9-5-4-2-1-3-10-7(4)13-6(5)8(11)12/h1-3H,(H,11,12)
InChI Key:
NNHOXSZGHYROQO-UHFFFAOYSA-N
SMILES:
OC(=O)c1sc2c(c1Br)cccn2
Properties
Complexity:
226  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
256.915g/mol
Formal Charge:
0
Heavy Atom Count:
13  
Hydrogen Bond Acceptor Count:
4  
Hydrogen Bond Donor Count:
1  
Isotope Atom Count:
0
Molecular Weight:
258.089g/mol
Monoisotopic Mass:
256.915g/mol
Rotatable Bond Count:
1  
Topological Polar Surface Area:
78.4A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
2.8  
Properties