Home Aminos 3-((2,5-Dimethylphenyl)amino)-3-oxopropanoic acid

3-((2,5-Dimethylphenyl)amino)-3-oxopropanoic acid

CAS No.:
6850-98-2
Catalog Number:
AG00FBT4
Molecular Formula:
C11H13NO3
Molecular Weight:
207.2258
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:
AG00FBT4
Chemical Name:
3-((2,5-Dimethylphenyl)amino)-3-oxopropanoic acid
CAS Number:
6850-98-2
Molecular Formula:
C11H13NO3
Molecular Weight:
207.2258
MDL Number:
MFCD08685827
IUPAC Name:
3-(2,5-dimethylanilino)-3-oxopropanoic acid
InChI:
InChI=1S/C11H13NO3/c1-7-3-4-8(2)9(5-7)12-10(13)6-11(14)15/h3-5H,6H2,1-2H3,(H,12,13)(H,14,15)
InChI Key:
WMDHWBXNSRIBCJ-UHFFFAOYSA-N
SMILES:
Cc1ccc(cc1NC(=O)CC(=O)O)C
Properties
Complexity:
252  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
207.09g/mol
Formal Charge:
0
Heavy Atom Count:
15  
Hydrogen Bond Acceptor Count:
3  
Hydrogen Bond Donor Count:
2  
Isotope Atom Count:
0
Molecular Weight:
207.229g/mol
Monoisotopic Mass:
207.09g/mol
Rotatable Bond Count:
3  
Topological Polar Surface Area:
66.4A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
1.7  
Properties