2-amino-2-[3-(trifluoromethyl)phenyl]acetic acid;hydrochloride


Chemical Name: 2-amino-2-[3-(trifluoromethyl)phenyl]acetic acid;hydrochloride
CAS Number: 1134915-25-5
Product Number: AG0008QN(AGN-PC-04Q6PN)
Synonyms:
MDL No: MFCD07371458
Molecular Formula: C9H9ClF3NO2
Molecular Weight: 255.6215

Identification/Properties


Computed Properties
Molecular Weight:
255.621g/mol
Hydrogen Bond Donor Count:
3
Hydrogen Bond Acceptor Count:
6
Rotatable Bond Count:
2
Exact Mass:
255.027g/mol
Monoisotopic Mass:
255.027g/mol
Topological Polar Surface Area:
63.3A^2
Heavy Atom Count:
16
Formal Charge:
0
Complexity:
242
Isotope Atom Count:
0
Defined Atom Stereocenter Count:
0
Undefined Atom Stereocenter Count:
1
Defined Bond Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
Covalently-Bonded Unit Count:
2
Compound Is Canonicalized:
Yes

Safety Information


GHS Pictogram:
Signal Word:
Warning
UN#:
-
Hazard Statements:
H302-H315-H319-H335
Precautionary Statements:
P261-P305+P351+P338
Class:
-
Packing Group:
-

NMR Spectrum


Other Analytical Data


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