Home Carbonyls 3-(3-Bromophenyl)-2-[(tert-butoxycarbonyl)amino]propanoic acid

3-(3-Bromophenyl)-2-[(tert-butoxycarbonyl)amino]propanoic acid

CAS No.:
82278-95-3
Catalog Number:
AG003AFQ
Molecular Formula:
C14H18BrNO4
Molecular Weight:
344.2010
Pack Size
Purity
Availability
Location
Price(USD)
Quantity
  
1g
98%
In Stock USA
United States
$63
- +
5g
98%
In Stock USA
United States
$250
- +
Product Description
Catalog Number:
AG003AFQ
Chemical Name:
3-(3-Bromophenyl)-2-[(tert-butoxycarbonyl)amino]propanoic acid
CAS Number:
82278-95-3
Molecular Formula:
C14H18BrNO4
Molecular Weight:
344.2010
MDL Number:
MFCD01317710
IUPAC Name:
3-(3-bromophenyl)-2-[(2-methylpropan-2-yl)oxycarbonylamino]propanoic acid
InChI:
InChI=1S/C14H18BrNO4/c1-14(2,3)20-13(19)16-11(12(17)18)8-9-5-4-6-10(15)7-9/h4-7,11H,8H2,1-3H3,(H,16,19)(H,17,18)
InChI Key:
FBUDYESOPLBQIR-UHFFFAOYSA-N
SMILES:
O=C(OC(C)(C)C)NC(C(=O)O)Cc1cccc(c1)Br
Properties
Complexity:
354  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
343.042g/mol
Formal Charge:
0
Heavy Atom Count:
20  
Hydrogen Bond Acceptor Count:
4  
Hydrogen Bond Donor Count:
2  
Isotope Atom Count:
0
Molecular Weight:
344.205g/mol
Monoisotopic Mass:
343.042g/mol
Rotatable Bond Count:
6  
Topological Polar Surface Area:
75.6A^2
Undefined Atom Stereocenter Count:
1  
Undefined Bond Stereocenter Count:
0
XLogP3:
3.2  
Properties