Home Aminos 4-[(2-phenylethyl)amino]butanoic acid hydrochloride

4-[(2-phenylethyl)amino]butanoic acid hydrochloride

CAS No.:
57054-99-6
Catalog Number:
AG019VWF
Molecular Formula:
C12H18ClNO2
Molecular Weight:
243.7298
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Product Description
Catalog Number:
AG019VWF
Chemical Name:
4-[(2-phenylethyl)amino]butanoic acid hydrochloride
CAS Number:
57054-99-6
Molecular Formula:
C12H18ClNO2
Molecular Weight:
243.7298
MDL Number:
MFCD12197259
IUPAC Name:
4-(2-phenylethylamino)butanoic acid;hydrochloride
InChI:
InChI=1S/C12H17NO2.ClH/c14-12(15)7-4-9-13-10-8-11-5-2-1-3-6-11;/h1-3,5-6,13H,4,7-10H2,(H,14,15);1H
InChI Key:
RCQSVXKXSMIFBX-UHFFFAOYSA-N
SMILES:
OC(=O)CCCNCCc1ccccc1.Cl
Properties
Complexity:
177  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
2  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
243.103g/mol
Formal Charge:
0
Heavy Atom Count:
16  
Hydrogen Bond Acceptor Count:
3  
Hydrogen Bond Donor Count:
3  
Isotope Atom Count:
0
Molecular Weight:
243.731g/mol
Monoisotopic Mass:
243.103g/mol
Rotatable Bond Count:
7  
Topological Polar Surface Area:
49.3A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
Properties