Home Halogens 6-Bromo-3-chloro-1-benzothiophene-2-carboxylic acid

6-Bromo-3-chloro-1-benzothiophene-2-carboxylic acid

CAS No.:
438613-29-7
Catalog Number:
AG00DAJR
Molecular Formula:
C9H4BrClO2S
Molecular Weight:
291.5489
Pack Size
Purity
Availability
Location
Price(USD)
Quantity
  
250mg
1 week
United States
$128
- +
1g
1 week
United States
$219
- +
5g
≥ 99% (HPLC)
1 week
United States
$981
- +
Product Description
Catalog Number:
AG00DAJR
Chemical Name:
6-Bromo-3-chloro-1-benzothiophene-2-carboxylic acid
CAS Number:
438613-29-7
Molecular Formula:
C9H4BrClO2S
Molecular Weight:
291.5489
MDL Number:
MFCD02090814
IUPAC Name:
6-bromo-3-chloro-1-benzothiophene-2-carboxylic acid
InChI:
InChI=1S/C9H4BrClO2S/c10-4-1-2-5-6(3-4)14-8(7(5)11)9(12)13/h1-3H,(H,12,13)
InChI Key:
YTGVICLKMKCFAJ-UHFFFAOYSA-N
SMILES:
Brc1ccc2c(c1)sc(c2Cl)C(=O)O
Properties
Complexity:
251  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
289.88g/mol
Formal Charge:
0
Heavy Atom Count:
14  
Hydrogen Bond Acceptor Count:
3  
Hydrogen Bond Donor Count:
1  
Isotope Atom Count:
0
Molecular Weight:
291.543g/mol
Monoisotopic Mass:
289.88g/mol
Rotatable Bond Count:
1  
Topological Polar Surface Area:
65.5A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
4.1  
Properties