Home Halogens Boc-(S)-3-Amino-4-(3-bromo-phenyl)-butyric acid

Boc-(S)-3-Amino-4-(3-bromo-phenyl)-butyric acid

CAS No.:
919988-44-6
Catalog Number:
AG00H081
Molecular Formula:
Molecular Weight:
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Product Description
Catalog Number:
AG00H081
Chemical Name:
Boc-(S)-3-Amino-4-(3-bromo-phenyl)-butyric acid
CAS Number:
919988-44-6
MDL Number:
MFCD24533644
IUPAC Name:
4-(3-bromophenyl)-3-[(2-methylpropan-2-yl)oxycarbonylamino]butanoic acid
InChI:
InChI=1S/C15H20BrNO4/c1-15(2,3)21-14(20)17-12(9-13(18)19)8-10-5-4-6-11(16)7-10/h4-7,12H,8-9H2,1-3H3,(H,17,20)(H,18,19)
InChI Key:
MDEDSOKOECEQFP-UHFFFAOYSA-N
Properties
Complexity:
367  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
357.058g/mol
Formal Charge:
0
Heavy Atom Count:
21  
Hydrogen Bond Acceptor Count:
4  
Hydrogen Bond Donor Count:
2  
Isotope Atom Count:
0
Molecular Weight:
358.232g/mol
Monoisotopic Mass:
357.058g/mol
Rotatable Bond Count:
7  
Topological Polar Surface Area:
75.6A^2
Undefined Atom Stereocenter Count:
1  
Undefined Bond Stereocenter Count:
0
XLogP3:
3.1  
Properties