Home Sulfos ethyl 2-amino-2-(4-methanesulfonylphenyl)propanoate hydrochloride

ethyl 2-amino-2-(4-methanesulfonylphenyl)propanoate hydrochloride

CAS No.:
1803592-52-0
Catalog Number:
AG01BHNH
Molecular Formula:
C12H18ClNO4S
Molecular Weight:
307.7936
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Product Description
Catalog Number:
AG01BHNH
Chemical Name:
ethyl 2-amino-2-(4-methanesulfonylphenyl)propanoate hydrochloride
CAS Number:
1803592-52-0
Molecular Formula:
C12H18ClNO4S
Molecular Weight:
307.7936
MDL Number:
MFCD28145335
IUPAC Name:
ethyl 2-amino-2-(4-methylsulfonylphenyl)propanoate;hydrochloride
InChI:
InChI=1S/C12H17NO4S.ClH/c1-4-17-11(14)12(2,13)9-5-7-10(8-6-9)18(3,15)16;/h5-8H,4,13H2,1-3H3;1H
InChI Key:
VTNAMILOUSKVPX-UHFFFAOYSA-N
SMILES:
CCOC(=O)C(c1ccc(cc1)S(=O)(=O)C)(N)C.Cl
Properties
Complexity:
393  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
2  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
307.065g/mol
Formal Charge:
0
Heavy Atom Count:
19  
Hydrogen Bond Acceptor Count:
5  
Hydrogen Bond Donor Count:
2  
Isotope Atom Count:
0
Molecular Weight:
307.789g/mol
Monoisotopic Mass:
307.065g/mol
Rotatable Bond Count:
5  
Topological Polar Surface Area:
94.8A^2
Undefined Atom Stereocenter Count:
1  
Undefined Bond Stereocenter Count:
0
Properties