Home Aminos 3-amino-2-[(3,4,5-trifluorophenyl)methyl]propanoic acid hydrochloride

3-amino-2-[(3,4,5-trifluorophenyl)methyl]propanoic acid hydrochloride

CAS No.:
1798747-21-3
Catalog Number:
AG01BE32
Molecular Formula:
C10H11ClF3NO2
Molecular Weight:
269.6480
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Product Description
Catalog Number:
AG01BE32
Chemical Name:
3-amino-2-[(3,4,5-trifluorophenyl)methyl]propanoic acid hydrochloride
CAS Number:
1798747-21-3
Molecular Formula:
C10H11ClF3NO2
Molecular Weight:
269.6480
MDL Number:
MFCD28118285
IUPAC Name:
2-(aminomethyl)-3-(3,4,5-trifluorophenyl)propanoic acid;hydrochloride
InChI:
InChI=1S/C10H10F3NO2.ClH/c11-7-2-5(3-8(12)9(7)13)1-6(4-14)10(15)16;/h2-3,6H,1,4,14H2,(H,15,16);1H
InChI Key:
VJNIJLMMPBENLY-UHFFFAOYSA-N
SMILES:
NCC(C(=O)O)Cc1cc(F)c(c(c1)F)F.Cl
Properties
Complexity:
240  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
2  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
269.043g/mol
Formal Charge:
0
Heavy Atom Count:
17  
Hydrogen Bond Acceptor Count:
6  
Hydrogen Bond Donor Count:
3  
Isotope Atom Count:
0
Molecular Weight:
269.648g/mol
Monoisotopic Mass:
269.043g/mol
Rotatable Bond Count:
4  
Topological Polar Surface Area:
63.3A^2
Undefined Atom Stereocenter Count:
1  
Undefined Bond Stereocenter Count:
0
Properties