Home Halogens 2-amino-2-(4-chloro-3-methylphenyl)acetic acid

2-amino-2-(4-chloro-3-methylphenyl)acetic acid

CAS No.:
1239646-77-5
Catalog Number:
AG01A5OC
Molecular Formula:
C9H10ClNO2
Molecular Weight:
199.6342
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Product Description
Catalog Number:
AG01A5OC
Chemical Name:
2-amino-2-(4-chloro-3-methylphenyl)acetic acid
CAS Number:
1239646-77-5
Molecular Formula:
C9H10ClNO2
Molecular Weight:
199.6342
MDL Number:
MFCD18705300
IUPAC Name:
2-amino-2-(4-chloro-3-methylphenyl)acetic acid
InChI:
InChI=1S/C9H10ClNO2/c1-5-4-6(2-3-7(5)10)8(11)9(12)13/h2-4,8H,11H2,1H3,(H,12,13)
InChI Key:
BDJQIXJYDWABPQ-UHFFFAOYSA-N
SMILES:
OC(=O)C(c1ccc(c(c1)C)Cl)N
Properties
Complexity:
198  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
199.04g/mol
Formal Charge:
0
Heavy Atom Count:
13  
Hydrogen Bond Acceptor Count:
3  
Hydrogen Bond Donor Count:
2  
Isotope Atom Count:
0
Molecular Weight:
199.634g/mol
Monoisotopic Mass:
199.04g/mol
Rotatable Bond Count:
2  
Topological Polar Surface Area:
63.3A^2
Undefined Atom Stereocenter Count:
1  
Undefined Bond Stereocenter Count:
0
XLogP3:
-0.7  
Properties