Home Halogens Benzeneacetic acid, α-amino-3,4-dichloro-

Benzeneacetic acid, α-amino-3,4-dichloro-

CAS No.:
128349-50-8
Catalog Number:
AG000Y01
Molecular Formula:
C8H7Cl2NO2
Molecular Weight:
220.0527
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Product Description
Catalog Number:
AG000Y01
Chemical Name:
Benzeneacetic acid, α-amino-3,4-dichloro-
CAS Number:
128349-50-8
Molecular Formula:
C8H7Cl2NO2
Molecular Weight:
220.0527
MDL Number:
MFCD03425231
IUPAC Name:
2-amino-2-(3,4-dichlorophenyl)acetic acid
InChI:
InChI=1S/C8H7Cl2NO2/c9-5-2-1-4(3-6(5)10)7(11)8(12)13/h1-3,7H,11H2,(H,12,13)
InChI Key:
NHRIRGQUPAYPDT-UHFFFAOYSA-N
SMILES:
OC(=O)C(c1ccc(c(c1)Cl)Cl)N
Properties
Complexity:
201  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
218.985g/mol
Formal Charge:
0
Heavy Atom Count:
13  
Hydrogen Bond Acceptor Count:
3  
Hydrogen Bond Donor Count:
2  
Isotope Atom Count:
0
Molecular Weight:
220.049g/mol
Monoisotopic Mass:
218.985g/mol
Rotatable Bond Count:
2  
Topological Polar Surface Area:
63.3A^2
Undefined Atom Stereocenter Count:
1  
Undefined Bond Stereocenter Count:
0
XLogP3:
-0.4  
Properties