Home Other Building Blocks 2-(5-ethyl-2,3-dioxo-2,3-dihydro-1H-indol-1-yl)acetic acid

2-(5-ethyl-2,3-dioxo-2,3-dihydro-1H-indol-1-yl)acetic acid

CAS No.:
19612-79-4
Catalog Number:
AG019UPC
Molecular Formula:
C12H11NO4
Molecular Weight:
233.2200
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Product Description
Catalog Number:
AG019UPC
Chemical Name:
2-(5-ethyl-2,3-dioxo-2,3-dihydro-1H-indol-1-yl)acetic acid
CAS Number:
19612-79-4
Molecular Formula:
C12H11NO4
Molecular Weight:
233.2200
MDL Number:
MFCD08899412
IUPAC Name:
2-(5-ethyl-2,3-dioxoindol-1-yl)acetic acid
InChI:
InChI=1S/C12H11NO4/c1-2-7-3-4-9-8(5-7)11(16)12(17)13(9)6-10(14)15/h3-5H,2,6H2,1H3,(H,14,15)
InChI Key:
FWOZWOSEGWGXMY-UHFFFAOYSA-N
SMILES:
CCc1ccc2c(c1)C(=O)C(=O)N2CC(=O)O
Properties
Complexity:
366  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
233.069g/mol
Formal Charge:
0
Heavy Atom Count:
17  
Hydrogen Bond Acceptor Count:
4  
Hydrogen Bond Donor Count:
1  
Isotope Atom Count:
0
Molecular Weight:
233.223g/mol
Monoisotopic Mass:
233.069g/mol
Rotatable Bond Count:
3  
Topological Polar Surface Area:
74.7A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
1.3  
Properties