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

5-Chloro-1-benzothiophene-2-carboxylic acid

CAS No.:
13771-75-0
Catalog Number:
AG0013RL
Molecular Formula:
C9H5ClO2S
Molecular Weight:
212.6528
Pack Size
Purity
Availability
Location
Price(USD)
Quantity
  
250mg
98%
In Stock USA
United States
$119
- +
1g
98%
In Stock USA
United States
$250
- +
5g
98%
In Stock USA
United States
$900
- +
10g
98%
In Stock USA
United States
$1350
- +
Product Description
Catalog Number:
AG0013RL
Chemical Name:
5-Chloro-1-benzothiophene-2-carboxylic acid
CAS Number:
13771-75-0
Molecular Formula:
C9H5ClO2S
Molecular Weight:
212.6528
MDL Number:
MFCD01927183
IUPAC Name:
5-chloro-1-benzothiophene-2-carboxylic acid
InChI:
InChI=1S/C9H5ClO2S/c10-6-1-2-7-5(3-6)4-8(13-7)9(11)12/h1-4H,(H,11,12)
InChI Key:
PKIXUVKUGMYKRU-UHFFFAOYSA-N
SMILES:
Clc1ccc2c(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:
211.97g/mol
Formal Charge:
0
Heavy Atom Count:
13  
Hydrogen Bond Acceptor Count:
3  
Hydrogen Bond Donor Count:
1  
Isotope Atom Count:
0
Molecular Weight:
212.647g/mol
Monoisotopic Mass:
211.97g/mol
Rotatable Bond Count:
1  
Topological Polar Surface Area:
65.5A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
3.4  
Properties