Home Carboxys 3-[(2-oxo-2,3-dihydro-1H-indol-1-yl)methyl]furan-2-carboxylic acid

3-[(2-oxo-2,3-dihydro-1H-indol-1-yl)methyl]furan-2-carboxylic acid

CAS No.:
1097140-95-8
Catalog Number:
AG01AANO
Molecular Formula:
C14H11NO4
Molecular Weight:
257.2414
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Product Description
Catalog Number:
AG01AANO
Chemical Name:
3-[(2-oxo-2,3-dihydro-1H-indol-1-yl)methyl]furan-2-carboxylic acid
CAS Number:
1097140-95-8
Molecular Formula:
C14H11NO4
Molecular Weight:
257.2414
MDL Number:
MFCD12652091
IUPAC Name:
3-[(2-oxo-3H-indol-1-yl)methyl]furan-2-carboxylic acid
InChI:
InChI=1S/C14H11NO4/c16-12-7-9-3-1-2-4-11(9)15(12)8-10-5-6-19-13(10)14(17)18/h1-6H,7-8H2,(H,17,18)
InChI Key:
VOWVIUIGYGGTCY-UHFFFAOYSA-N
SMILES:
OC(=O)c1occc1CN1C(=O)Cc2c1cccc2
Properties
Complexity:
384  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
257.069g/mol
Formal Charge:
0
Heavy Atom Count:
19  
Hydrogen Bond Acceptor Count:
4  
Hydrogen Bond Donor Count:
1  
Isotope Atom Count:
0
Molecular Weight:
257.245g/mol
Monoisotopic Mass:
257.069g/mol
Rotatable Bond Count:
3  
Topological Polar Surface Area:
70.8A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
1.4  
Properties