Home Carboxys 5-(4-Aminophenyl)furan-2-carboxylic acid methyl ester

5-(4-Aminophenyl)furan-2-carboxylic acid methyl ester

CAS No.:
52939-06-7
Catalog Number:
AG00D9V0
Molecular Formula:
C12H11NO3
Molecular Weight:
217.2206
Pack Size
Purity
Availability
Location
Price(USD)
Quantity
  
1g
98%
In Stock USA
United States
$100
- +
5g
98%
In Stock USA
United States
$400
- +
Product Description
Catalog Number:
AG00D9V0
Chemical Name:
5-(4-Aminophenyl)furan-2-carboxylic acid methyl ester
CAS Number:
52939-06-7
Molecular Formula:
C12H11NO3
Molecular Weight:
217.2206
MDL Number:
MFCD06797396
IUPAC Name:
methyl 5-(4-aminophenyl)furan-2-carboxylate
InChI:
InChI=1S/C12H11NO3/c1-15-12(14)11-7-6-10(16-11)8-2-4-9(13)5-3-8/h2-7H,13H2,1H3
InChI Key:
JOIQXOMSFVFDQY-UHFFFAOYSA-N
SMILES:
COC(=O)c1ccc(o1)c1ccc(cc1)N
Properties
Complexity:
249  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
217.074g/mol
Formal Charge:
0
Heavy Atom Count:
16  
Hydrogen Bond Acceptor Count:
4  
Hydrogen Bond Donor Count:
1  
Isotope Atom Count:
0
Molecular Weight:
217.224g/mol
Monoisotopic Mass:
217.074g/mol
Rotatable Bond Count:
3  
Topological Polar Surface Area:
65.5A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
2.2  
Properties