Home Aminos methyl (3R)-3-amino-3-(2-ethoxyphenyl)propanoate hydrochloride

methyl (3R)-3-amino-3-(2-ethoxyphenyl)propanoate hydrochloride

CAS No.:
1306728-63-1
Catalog Number:
AG01AICL
Molecular Formula:
C12H18ClNO3
Molecular Weight:
259.7292
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Product Description
Catalog Number:
AG01AICL
Chemical Name:
methyl (3R)-3-amino-3-(2-ethoxyphenyl)propanoate hydrochloride
CAS Number:
1306728-63-1
Molecular Formula:
C12H18ClNO3
Molecular Weight:
259.7292
MDL Number:
MFCD18839003
IUPAC Name:
methyl (3R)-3-amino-3-(2-ethoxyphenyl)propanoate;hydrochloride
InChI:
InChI=1S/C12H17NO3.ClH/c1-3-16-11-7-5-4-6-9(11)10(13)8-12(14)15-2;/h4-7,10H,3,8,13H2,1-2H3;1H/t10-;/m1./s1
InChI Key:
WTBZOHYJGNLMEQ-HNCPQSOCSA-N
SMILES:
CCOc1ccccc1[C@@H](CC(=O)OC)N.Cl
Properties
Complexity:
220  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
2  
Defined Atom Stereocenter Count:
1  
Defined Bond Stereocenter Count:
0
Exact Mass:
259.098g/mol
Formal Charge:
0
Heavy Atom Count:
17  
Hydrogen Bond Acceptor Count:
4  
Hydrogen Bond Donor Count:
2  
Isotope Atom Count:
0
Molecular Weight:
259.73g/mol
Monoisotopic Mass:
259.098g/mol
Rotatable Bond Count:
6  
Topological Polar Surface Area:
61.6A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
Properties