Home Aminos methyl 3-amino-2-[(3-fluorophenyl)methyl]propanoate hydrochloride

methyl 3-amino-2-[(3-fluorophenyl)methyl]propanoate hydrochloride

CAS No.:
1258652-42-4
Catalog Number:
AG01AB6A
Molecular Formula:
C11H15ClFNO2
Molecular Weight:
247.6937
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Product Description
Catalog Number:
AG01AB6A
Chemical Name:
methyl 3-amino-2-[(3-fluorophenyl)methyl]propanoate hydrochloride
CAS Number:
1258652-42-4
Molecular Formula:
C11H15ClFNO2
Molecular Weight:
247.6937
MDL Number:
MFCD17977088
IUPAC Name:
methyl 2-(aminomethyl)-3-(3-fluorophenyl)propanoate;hydrochloride
InChI:
InChI=1S/C11H14FNO2.ClH/c1-15-11(14)9(7-13)5-8-3-2-4-10(12)6-8;/h2-4,6,9H,5,7,13H2,1H3;1H
InChI Key:
NZYMHDXBKOLDTF-UHFFFAOYSA-N
SMILES:
NCC(C(=O)OC)Cc1cccc(c1)F.Cl
Properties
Complexity:
211  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
2  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
247.078g/mol
Formal Charge:
0
Heavy Atom Count:
16  
Hydrogen Bond Acceptor Count:
4  
Hydrogen Bond Donor Count:
2  
Isotope Atom Count:
0
Molecular Weight:
247.694g/mol
Monoisotopic Mass:
247.078g/mol
Rotatable Bond Count:
5  
Topological Polar Surface Area:
52.3A^2
Undefined Atom Stereocenter Count:
1  
Undefined Bond Stereocenter Count:
0
Properties