Home Other Building Blocks 3-[4-(2-Aminoethyl)phenyl]propanoic acid HCl

3-[4-(2-Aminoethyl)phenyl]propanoic acid HCl

CAS No.:
79093-91-7
Catalog Number:
AG01DXEL
Molecular Formula:
C11H16ClNO2
Molecular Weight:
229.7032
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Product Description
Catalog Number:
AG01DXEL
Chemical Name:
3-[4-(2-Aminoethyl)phenyl]propanoic acid HCl
CAS Number:
79093-91-7
Molecular Formula:
C11H16ClNO2
Molecular Weight:
229.7032
MDL Number:
MFCD31704887
IUPAC Name:
3-[4-(2-aminoethyl)phenyl]propanoic acid;hydrochloride
InChI:
InChI=1S/C11H15NO2.ClH/c12-8-7-10-3-1-9(2-4-10)5-6-11(13)14;/h1-4H,5-8,12H2,(H,13,14);1H
InChI Key:
LSQKVHPEBARDDI-UHFFFAOYSA-N
SMILES:
NCCc1ccc(cc1)CCC(=O)O.Cl
Properties
Complexity:
174  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
2  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
229.087g/mol
Formal Charge:
0
Heavy Atom Count:
15  
Hydrogen Bond Acceptor Count:
3  
Hydrogen Bond Donor Count:
3  
Isotope Atom Count:
0
Molecular Weight:
229.704g/mol
Monoisotopic Mass:
229.087g/mol
Rotatable Bond Count:
5  
Topological Polar Surface Area:
63.3A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
Properties