Home Halogens 2-Aminomethyl-3-(3,4-dichloro-phenyl)-propionic acid

2-Aminomethyl-3-(3,4-dichloro-phenyl)-propionic acid

CAS No.:
682803-15-2
Catalog Number:
AG003ITY
Molecular Formula:
C10H11Cl2NO2
Molecular Weight:
248.1058
Pack Size
Purity
Availability
Location
Price(USD)
Quantity
  
1g
>95%
In Stock USA
United States
$290
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Product Description
Catalog Number:
AG003ITY
Chemical Name:
2-Aminomethyl-3-(3,4-dichloro-phenyl)-propionic acid
CAS Number:
682803-15-2
Molecular Formula:
C10H11Cl2NO2
Molecular Weight:
248.1058
MDL Number:
MFCD03002396
IUPAC Name:
2-(aminomethyl)-3-(3,4-dichlorophenyl)propanoic acid
InChI:
InChI=1S/C10H11Cl2NO2/c11-8-2-1-6(4-9(8)12)3-7(5-13)10(14)15/h1-2,4,7H,3,5,13H2,(H,14,15)
InChI Key:
OWUCQTYNFQLYOY-UHFFFAOYSA-N
SMILES:
NCC(C(=O)O)Cc1ccc(c(c1)Cl)Cl
Properties
Complexity:
226  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
247.017g/mol
Formal Charge:
0
Heavy Atom Count:
15  
Hydrogen Bond Acceptor Count:
3  
Hydrogen Bond Donor Count:
2  
Isotope Atom Count:
0
Molecular Weight:
248.103g/mol
Monoisotopic Mass:
247.017g/mol
Rotatable Bond Count:
4  
Topological Polar Surface Area:
63.3A^2
Undefined Atom Stereocenter Count:
1  
Undefined Bond Stereocenter Count:
0
XLogP3:
-0.3  
Properties