Home Carboxys 1-Benzothiophene-5-carboxylic acid

1-Benzothiophene-5-carboxylic acid

CAS No.:
2060-64-2
Catalog Number:
AG002AGV
Molecular Formula:
C9H6O2S
Molecular Weight:
178.2077
Pack Size
Purity
Availability
Location
Price(USD)
Quantity
  
250mg
97%
In Stock USA
United States
$82
- +
1g
97%
In Stock USA
United States
$238
- +
5g
97%
In Stock USA
United States
$688
- +
10g
97%
In Stock USA
United States
$1025
- +
Product Description
Catalog Number:
AG002AGV
Chemical Name:
1-Benzothiophene-5-carboxylic acid
CAS Number:
2060-64-2
Molecular Formula:
C9H6O2S
Molecular Weight:
178.2077
MDL Number:
MFCD04974042
IUPAC Name:
1-benzothiophene-5-carboxylic acid
InChI:
InChI=1S/C9H6O2S/c10-9(11)7-1-2-8-6(5-7)3-4-12-8/h1-5H,(H,10,11)
InChI Key:
SNBYTKLWZRHESA-UHFFFAOYSA-N
SMILES:
OC(=O)c1ccc2c(c1)ccs2
Properties
Complexity:
193  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
178.009g/mol
Formal Charge:
0
Heavy Atom Count:
12  
Hydrogen Bond Acceptor Count:
3  
Hydrogen Bond Donor Count:
1  
Isotope Atom Count:
0
Molecular Weight:
178.205g/mol
Monoisotopic Mass:
178.009g/mol
Rotatable Bond Count:
1  
Topological Polar Surface Area:
65.5A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
2.6  
Properties