Home Halogens 2-[(2,4-dichlorophenyl)amino]propanoic acid

2-[(2,4-dichlorophenyl)amino]propanoic acid

CAS No.:
72629-78-8
Catalog Number:
AG01AAUM
Molecular Formula:
C9H9Cl2NO2
Molecular Weight:
234.0793
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Product Description
Catalog Number:
AG01AAUM
Chemical Name:
2-[(2,4-dichlorophenyl)amino]propanoic acid
CAS Number:
72629-78-8
Molecular Formula:
C9H9Cl2NO2
Molecular Weight:
234.0793
MDL Number:
MFCD16088434
IUPAC Name:
2-(2,4-dichloroanilino)propanoic acid
InChI:
InChI=1S/C9H9Cl2NO2/c1-5(9(13)14)12-8-3-2-6(10)4-7(8)11/h2-5,12H,1H3,(H,13,14)
InChI Key:
JNLZQDCKJDMRPL-UHFFFAOYSA-N
SMILES:
OC(=O)C(Nc1ccc(cc1Cl)Cl)C
Properties
Complexity:
213  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
233.001g/mol
Formal Charge:
0
Heavy Atom Count:
14  
Hydrogen Bond Acceptor Count:
3  
Hydrogen Bond Donor Count:
2  
Isotope Atom Count:
0
Molecular Weight:
234.076g/mol
Monoisotopic Mass:
233.001g/mol
Rotatable Bond Count:
3  
Topological Polar Surface Area:
49.3A^2
Undefined Atom Stereocenter Count:
1  
Undefined Bond Stereocenter Count:
0
XLogP3:
3.2  
Properties