Home Halogens 3-Amino-3-(4-bromophenyl)propanoic acid

3-Amino-3-(4-bromophenyl)propanoic acid

CAS No.:
39773-47-2
Catalog Number:
AG003IUT
Molecular Formula:
C9H10BrNO2
Molecular Weight:
244.0852
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Purity
Availability
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Price(USD)
Quantity
  
1g
>97%
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United States
$44
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Product Description
Catalog Number:
AG003IUT
Chemical Name:
3-Amino-3-(4-bromophenyl)propanoic acid
CAS Number:
39773-47-2
Molecular Formula:
C9H10BrNO2
Molecular Weight:
244.0852
MDL Number:
MFCD00048245
IUPAC Name:
3-amino-3-(4-bromophenyl)propanoic acid
InChI:
InChI=1S/C9H10BrNO2/c10-7-3-1-6(2-4-7)8(11)5-9(12)13/h1-4,8H,5,11H2,(H,12,13)
InChI Key:
RBOUYDUXPMAYMJ-UHFFFAOYSA-N
SMILES:
NC(c1ccc(cc1)Br)CC(=O)O
Properties
Complexity:
179  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
242.989g/mol
Formal Charge:
0
Heavy Atom Count:
13  
Hydrogen Bond Acceptor Count:
3  
Hydrogen Bond Donor Count:
2  
Isotope Atom Count:
0
Molecular Weight:
244.088g/mol
Monoisotopic Mass:
242.989g/mol
Rotatable Bond Count:
3  
Topological Polar Surface Area:
63.3A^2
Undefined Atom Stereocenter Count:
1  
Undefined Bond Stereocenter Count:
0
XLogP3:
-0.7  
Properties