Home Carboxys 2-(Methoxycarbonyl)thiophene-3-carboxylic acid

2-(Methoxycarbonyl)thiophene-3-carboxylic acid

CAS No.:
115777-72-5
Catalog Number:
AG000GUP
Molecular Formula:
C7H5O4S-
Molecular Weight:
185.1772
Pack Size
Purity
Availability
Location
Price(USD)
Quantity
  
250mg
98%
In Stock USA
United States
$200
- +
1g
98%
In Stock USA
United States
$500
- +
5g
98%
In Stock USA
United States
$1875
- +
Product Description
Catalog Number:
AG000GUP
Chemical Name:
2-(Methoxycarbonyl)thiophene-3-carboxylic acid
CAS Number:
115777-72-5
Molecular Formula:
C7H5O4S-
Molecular Weight:
185.1772
MDL Number:
MFCD20640613
IUPAC Name:
2-methoxycarbonylthiophene-3-carboxylic acid
InChI:
InChI=1S/C7H6O4S/c1-11-7(10)5-4(6(8)9)2-3-12-5/h2-3H,1H3,(H,8,9)
InChI Key:
XLKOQFSMGITOGW-UHFFFAOYSA-N
SMILES:
COC(=O)c1sccc1C(=O)[O-]
Properties
Complexity:
204  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
185.999g/mol
Formal Charge:
0
Heavy Atom Count:
12  
Hydrogen Bond Acceptor Count:
5  
Hydrogen Bond Donor Count:
1  
Isotope Atom Count:
0
Molecular Weight:
186.181g/mol
Monoisotopic Mass:
185.999g/mol
Rotatable Bond Count:
3  
Topological Polar Surface Area:
91.8A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
1.3  
Properties