Home Carbonyls 2-(3-Bromophenyl)-2-((tert-butoxycarbonyl)amino)acetic acid

2-(3-Bromophenyl)-2-((tert-butoxycarbonyl)amino)acetic acid

CAS No.:
446305-66-4
Catalog Number:
AG018GR5
Molecular Formula:
C13H16BrNO4
Molecular Weight:
330.1744
Pack Size
Purity
Availability
Location
Price(USD)
Quantity
  
250mg
95%
1 week
United States
$212
- +
1g
95%
1 week
United States
$471
- +
Product Description
Catalog Number:
AG018GR5
Chemical Name:
2-(3-Bromophenyl)-2-((tert-butoxycarbonyl)amino)acetic acid
CAS Number:
446305-66-4
Molecular Formula:
C13H16BrNO4
Molecular Weight:
330.1744
MDL Number:
MFCD07388845
IUPAC Name:
2-(3-bromophenyl)-2-[(2-methylpropan-2-yl)oxycarbonylamino]acetic acid
InChI:
InChI=1S/C13H16BrNO4/c1-13(2,3)19-12(18)15-10(11(16)17)8-5-4-6-9(14)7-8/h4-7,10H,1-3H3,(H,15,18)(H,16,17)
InChI Key:
ZHAAYALRXSZQLX-UHFFFAOYSA-N
SMILES:
O=C(OC(C)(C)C)NC(c1cccc(c1)Br)C(=O)O
Properties
Complexity:
340  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
329.026g/mol
Formal Charge:
0
Heavy Atom Count:
19  
Hydrogen Bond Acceptor Count:
4  
Hydrogen Bond Donor Count:
2  
Isotope Atom Count:
0
Molecular Weight:
330.178g/mol
Monoisotopic Mass:
329.026g/mol
Rotatable Bond Count:
5  
Topological Polar Surface Area:
75.6A^2
Undefined Atom Stereocenter Count:
1  
Undefined Bond Stereocenter Count:
0
XLogP3:
2.9  
Properties