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Home Carboxys 2-(3,4-Dimethylphenyl)-1,3-dioxoisoindoline-5-carboxylic acid

2-(3,4-Dimethylphenyl)-1,3-dioxoisoindoline-5-carboxylic acid

CAS No.:
294667-04-2
Catalog Number:
AG002YH1
Molecular Formula:
C17H13NO4
Molecular Weight:
295.2894
Pack Size
Purity
Availability
Location
Price(USD)
Quantity
  
1g
95%
In Stock USA
United States
$96
- +
5g
95%
In Stock USA
United States
$216
- +
Product Description
Catalog Number:
AG002YH1
Chemical Name:
2-(3,4-Dimethylphenyl)-1,3-dioxoisoindoline-5-carboxylic acid
CAS Number:
294667-04-2
Molecular Formula:
C17H13NO4
Molecular Weight:
295.2894
MDL Number:
MFCD00404561
IUPAC Name:
2-(3,4-dimethylphenyl)-1,3-dioxoisoindole-5-carboxylic acid
InChI:
InChI=1S/C17H13NO4/c1-9-3-5-12(7-10(9)2)18-15(19)13-6-4-11(17(21)22)8-14(13)16(18)20/h3-8H,1-2H3,(H,21,22)
InChI Key:
ZXKKQWJCKYOQMO-UHFFFAOYSA-N
SMILES:
OC(=O)c1ccc2c(c1)C(=O)N(C2=O)c1ccc(c(c1)C)C
Properties
Complexity:
503  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
295.084g/mol
Formal Charge:
0
Heavy Atom Count:
22  
Hydrogen Bond Acceptor Count:
4  
Hydrogen Bond Donor Count:
1  
Isotope Atom Count:
0
Molecular Weight:
295.294g/mol
Monoisotopic Mass:
295.084g/mol
Rotatable Bond Count:
2  
Topological Polar Surface Area:
74.7A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
2.7  
Literature
Title Journal
Microsphere-based protease assays and screening application for lethal factor and factor Xa. Cytometry. Part A : the journal of the International Society for Analytical Cytology 20060501
Properties