Home Halogens 2-Thiophenecarboxylic acid, 5-bromo-4-chloro-

2-Thiophenecarboxylic acid, 5-bromo-4-chloro-

CAS No.:
123418-69-9
Catalog Number:
AG000KJV
Molecular Formula:
C5H2BrClO2S
Molecular Weight:
241.4902
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Product Description
Catalog Number:
AG000KJV
Chemical Name:
2-Thiophenecarboxylic acid, 5-bromo-4-chloro-
CAS Number:
123418-69-9
Molecular Formula:
C5H2BrClO2S
Molecular Weight:
241.4902
MDL Number:
MFCD08694669
IUPAC Name:
5-bromo-4-chlorothiophene-2-carboxylic acid
InChI:
InChI=1S/C5H2BrClO2S/c6-4-2(7)1-3(10-4)5(8)9/h1H,(H,8,9)
InChI Key:
KDAAIEHVVGYWRT-UHFFFAOYSA-N
SMILES:
OC(=O)c1cc(c(s1)Br)Cl
Properties
Complexity:
155  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
239.865g/mol
Formal Charge:
0
Heavy Atom Count:
10  
Hydrogen Bond Acceptor Count:
3  
Hydrogen Bond Donor Count:
1  
Isotope Atom Count:
0
Molecular Weight:
241.483g/mol
Monoisotopic Mass:
239.865g/mol
Rotatable Bond Count:
1  
Topological Polar Surface Area:
65.5A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
3.1  
Properties