Home Aminos Methyl (2s)-2-amino-3-(4-iodophenyl)propanoate

Methyl (2s)-2-amino-3-(4-iodophenyl)propanoate

CAS No.:
113850-77-4
Catalog Number:
AG0096CG
Molecular Formula:
C10H12INO2
Molecular Weight:
305.1123
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Product Description
Catalog Number:
AG0096CG
Chemical Name:
Methyl (2s)-2-amino-3-(4-iodophenyl)propanoate
CAS Number:
113850-77-4
Molecular Formula:
C10H12INO2
Molecular Weight:
305.1123
MDL Number:
MFCD08058398
IUPAC Name:
methyl (2S)-2-amino-3-(4-iodophenyl)propanoate
InChI:
InChI=1S/C10H12INO2/c1-14-10(13)9(12)6-7-2-4-8(11)5-3-7/h2-5,9H,6,12H2,1H3/t9-/m0/s1
InChI Key:
FFJCJOBIONHKJL-VIFPVBQESA-N
SMILES:
COC(=O)[C@H](Cc1ccc(cc1)I)N
Properties
Complexity:
191  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
1  
Defined Bond Stereocenter Count:
0
Exact Mass:
304.991g/mol
Formal Charge:
0
Heavy Atom Count:
14  
Hydrogen Bond Acceptor Count:
3  
Hydrogen Bond Donor Count:
1  
Isotope Atom Count:
0
Molecular Weight:
305.115g/mol
Monoisotopic Mass:
304.991g/mol
Rotatable Bond Count:
4  
Topological Polar Surface Area:
52.3A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
1.8  
Properties