Home Carboxys Methyl 5-benzoyl-furan-2-carboxylate

Methyl 5-benzoyl-furan-2-carboxylate

CAS No.:
58972-21-7
Catalog Number:
AG00IAH5
Molecular Formula:
C13H10O4
Molecular Weight:
230.2161
Pack Size
Purity
Availability
Location
Price(USD)
Quantity
  
1g
97%
1 week
United States
$109
- +
5g
97%
1 week
United States
$321
- +
Product Description
Catalog Number:
AG00IAH5
Chemical Name:
Methyl 5-benzoyl-furan-2-carboxylate
CAS Number:
58972-21-7
Molecular Formula:
C13H10O4
Molecular Weight:
230.2161
MDL Number:
MFCD07779120
IUPAC Name:
methyl 5-benzoylfuran-2-carboxylate
InChI:
InChI=1S/C13H10O4/c1-16-13(15)11-8-7-10(17-11)12(14)9-5-3-2-4-6-9/h2-8H,1H3
InChI Key:
FILYPAWPUAUFFC-UHFFFAOYSA-N
SMILES:
COC(=O)c1ccc(o1)C(=O)c1ccccc1
Properties
Complexity:
294  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
230.058g/mol
Formal Charge:
0
Heavy Atom Count:
17  
Hydrogen Bond Acceptor Count:
4  
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
230.219g/mol
Monoisotopic Mass:
230.058g/mol
Rotatable Bond Count:
4  
Topological Polar Surface Area:
56.5A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
2.8  
Properties