Home Carboxys 5-Fluoro-1-benzothiophene-2-carboxylic acid

5-Fluoro-1-benzothiophene-2-carboxylic acid

CAS No.:
70060-13-8
Catalog Number:
AG0038H2
Molecular Formula:
C9H5FO2S
Molecular Weight:
196.1982
Pack Size
Purity
Availability
Location
Price(USD)
Quantity
  
1g
98%
In Stock USA
United States
$50
- +
5g
98%
In Stock USA
United States
$213
- +
25g
98%
In Stock USA
United States
$788
- +
Product Description
Catalog Number:
AG0038H2
Chemical Name:
5-Fluoro-1-benzothiophene-2-carboxylic acid
CAS Number:
70060-13-8
Molecular Formula:
C9H5FO2S
Molecular Weight:
196.1982
MDL Number:
MFCD01927184
IUPAC Name:
5-fluoro-1-benzothiophene-2-carboxylic acid
InChI:
InChI=1S/C9H5FO2S/c10-6-1-2-7-5(3-6)4-8(13-7)9(11)12/h1-4H,(H,11,12)
InChI Key:
PLVPMOSTGNZKQQ-UHFFFAOYSA-N
SMILES:
Fc1ccc2c(c1)cc(s2)C(=O)O
Properties
Complexity:
222  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
195.999g/mol
Formal Charge:
0
Heavy Atom Count:
13  
Hydrogen Bond Acceptor Count:
4  
Hydrogen Bond Donor Count:
1  
Isotope Atom Count:
0
Molecular Weight:
196.195g/mol
Monoisotopic Mass:
195.999g/mol
Rotatable Bond Count:
1  
Topological Polar Surface Area:
65.5A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
2.9  
Properties