Home Aminos 3-[(2,4-dimethylphenyl)amino]-3-oxopropanoic acid

3-[(2,4-dimethylphenyl)amino]-3-oxopropanoic acid

CAS No.:
58271-38-8
Catalog Number:
AG00EC1V
Molecular Formula:
C11H13NO3
Molecular Weight:
207.2258
Pack Size
Purity
Availability
Location
Price(USD)
Quantity
  
1g
95%
In Stock USA
United States
$96
- +
Product Description
Catalog Number:
AG00EC1V
Chemical Name:
3-[(2,4-dimethylphenyl)amino]-3-oxopropanoic acid
CAS Number:
58271-38-8
Molecular Formula:
C11H13NO3
Molecular Weight:
207.2258
MDL Number:
MFCD08685826
IUPAC Name:
3-(2,4-dimethylanilino)-3-oxopropanoic acid
InChI:
InChI=1S/C11H13NO3/c1-7-3-4-9(8(2)5-7)12-10(13)6-11(14)15/h3-5H,6H2,1-2H3,(H,12,13)(H,14,15)
InChI Key:
BIJQKKGPZNKXKX-UHFFFAOYSA-N
SMILES:
O=C(Nc1ccc(cc1C)C)CC(=O)O
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