Home Other Building Blocks BOC-3,5-DIIODO-TYR(3'-BROMO-BZL)-OH

BOC-3,5-DIIODO-TYR(3'-BROMO-BZL)-OH

CAS No.:
63570-43-4
Catalog Number:
AG00EGQJ
Molecular Formula:
C21H22BrI2NO5
Molecular Weight:
702.1160
Pack Size
Purity
Availability
Location
Price(USD)
Quantity
  
1g
≥ 98%
1 week
United States
$159
- +
5g
≥ 98%
1 week
United States
$567
- +
25g
≥ 98%
1 week
United States
$1475
- +
Product Description
Catalog Number:
AG00EGQJ
Chemical Name:
BOC-3,5-DIIODO-TYR(3'-BROMO-BZL)-OH
CAS Number:
63570-43-4
Molecular Formula:
C21H22BrI2NO5
Molecular Weight:
702.1160
MDL Number:
MFCD00037099
IUPAC Name:
(2S)-3-[4-[(3-bromophenyl)methoxy]-3,5-diiodophenyl]-2-[(2-methylpropan-2-yl)oxycarbonylamino]propanoic acid
InChI:
InChI=1S/C21H22BrI2NO5/c1-21(2,3)30-20(28)25-17(19(26)27)10-13-8-15(23)18(16(24)9-13)29-11-12-5-4-6-14(22)7-12/h4-9,17H,10-11H2,1-3H3,(H,25,28)(H,26,27)/t17-/m0/s1
InChI Key:
LQBZOEUOEXIJCY-KRWDZBQOSA-N
SMILES:
O=C(OC(C)(C)C)N[C@H](C(=O)O)Cc1cc(I)c(c(c1)I)OCc1cccc(c1)Br
Properties
Complexity:
576  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
1  
Defined Bond Stereocenter Count:
0
Exact Mass:
700.877g/mol
Formal Charge:
0
Heavy Atom Count:
30  
Hydrogen Bond Acceptor Count:
5  
Hydrogen Bond Donor Count:
2  
Isotope Atom Count:
0
Molecular Weight:
702.122g/mol
Monoisotopic Mass:
700.877g/mol
Rotatable Bond Count:
9  
Topological Polar Surface Area:
84.9A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
6  
Properties