Home Aminos ethyl 2-amino-3-(1-benzothiophen-3-yl)propanoate hydrochloride

ethyl 2-amino-3-(1-benzothiophen-3-yl)propanoate hydrochloride

CAS No.:
116654-74-1
Catalog Number:
AG01EJG5
Molecular Formula:
C13H16ClNO2S
Molecular Weight:
285.7896
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Product Description
Catalog Number:
AG01EJG5
Chemical Name:
ethyl 2-amino-3-(1-benzothiophen-3-yl)propanoate hydrochloride
CAS Number:
116654-74-1
Molecular Formula:
C13H16ClNO2S
Molecular Weight:
285.7896
MDL Number:
MFCD31629397
IUPAC Name:
ethyl 2-amino-3-(1-benzothiophen-3-yl)propanoate;hydrochloride
InChI:
InChI=1S/C13H15NO2S.ClH/c1-2-16-13(15)11(14)7-9-8-17-12-6-4-3-5-10(9)12;/h3-6,8,11H,2,7,14H2,1H3;1H
InChI Key:
IECNTWLBLDTLGP-UHFFFAOYSA-N
SMILES:
CCOC(=O)C(Cc1csc2c1cccc2)N.Cl
Properties
Complexity:
272  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
2  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
285.059g/mol
Formal Charge:
0
Heavy Atom Count:
18  
Hydrogen Bond Acceptor Count:
4  
Hydrogen Bond Donor Count:
2  
Isotope Atom Count:
0
Molecular Weight:
285.786g/mol
Monoisotopic Mass:
285.059g/mol
Rotatable Bond Count:
5  
Topological Polar Surface Area:
80.6A^2
Undefined Atom Stereocenter Count:
1  
Undefined Bond Stereocenter Count:
0
Properties