Home Carboxys 5-Chloro-7-methoxybenzofuran-2-carboxylic acid

5-Chloro-7-methoxybenzofuran-2-carboxylic acid

CAS No.:
460044-74-0
Catalog Number:
AG00D9AJ
Molecular Formula:
C10H7ClO4
Molecular Weight:
226.6132
Pack Size
Purity
Availability
Location
Price(USD)
Quantity
  
1g
95%
In Stock USA
United States
$168
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Product Description
Catalog Number:
AG00D9AJ
Chemical Name:
5-Chloro-7-methoxybenzofuran-2-carboxylic acid
CAS Number:
460044-74-0
Molecular Formula:
C10H7ClO4
Molecular Weight:
226.6132
MDL Number:
MFCD03119387
IUPAC Name:
5-chloro-7-methoxy-1-benzofuran-2-carboxylic acid
InChI:
InChI=1S/C10H7ClO4/c1-14-7-4-6(11)2-5-3-8(10(12)13)15-9(5)7/h2-4H,1H3,(H,12,13)
InChI Key:
SJIWXWCGQMFLNE-UHFFFAOYSA-N
SMILES:
COc1cc(Cl)cc2c1oc(c2)C(=O)O
Properties
Complexity:
258  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
226.003g/mol
Formal Charge:
0
Heavy Atom Count:
15  
Hydrogen Bond Acceptor Count:
4  
Hydrogen Bond Donor Count:
1  
Isotope Atom Count:
0
Molecular Weight:
226.612g/mol
Monoisotopic Mass:
226.003g/mol
Rotatable Bond Count:
2  
Topological Polar Surface Area:
59.7A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
2.8  
Properties