Home Aminos 4-amino-3-(2,3-dihydro-1-benzofuran-5-yl)butanoic acid hydrochloride

4-amino-3-(2,3-dihydro-1-benzofuran-5-yl)butanoic acid hydrochloride

CAS No.:
2138274-19-6
Catalog Number:
AG01ELP4
Molecular Formula:
C12H16ClNO3
Molecular Weight:
257.7133
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Product Description
Catalog Number:
AG01ELP4
Chemical Name:
4-amino-3-(2,3-dihydro-1-benzofuran-5-yl)butanoic acid hydrochloride
CAS Number:
2138274-19-6
Molecular Formula:
C12H16ClNO3
Molecular Weight:
257.7133
MDL Number:
MFCD31446553
IUPAC Name:
4-amino-3-(2,3-dihydro-1-benzofuran-5-yl)butanoic acid;hydrochloride
InChI:
InChI=1S/C12H15NO3.ClH/c13-7-10(6-12(14)15)8-1-2-11-9(5-8)3-4-16-11;/h1-2,5,10H,3-4,6-7,13H2,(H,14,15);1H
InChI Key:
LQVJLRDAGFSJCS-UHFFFAOYSA-N
SMILES:
NCC(c1ccc2c(c1)CCO2)CC(=O)O.Cl
Properties
Complexity:
257  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
2  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
257.082g/mol
Formal Charge:
0
Heavy Atom Count:
17  
Hydrogen Bond Acceptor Count:
4  
Hydrogen Bond Donor Count:
3  
Isotope Atom Count:
0
Molecular Weight:
257.714g/mol
Monoisotopic Mass:
257.082g/mol
Rotatable Bond Count:
4  
Topological Polar Surface Area:
72.6A^2
Undefined Atom Stereocenter Count:
1  
Undefined Bond Stereocenter Count:
0
Properties