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79028-57-2 | tertiary-butyloxycarbonyl-L-iodotyrosine-N-hydroxysuccininimide ester
CAS No: 79028-57-2 Catalog No: AG00GHA0 MDL No:
Product Description
Catalog Number:
AG00GHA0
Chemical Name:
tertiary-butyloxycarbonyl-L-iodotyrosine-N-hydroxysuccininimide ester
CAS Number:
79028-57-2
IUPAC Name:
(2,5-dioxopyrrolidin-1-yl) (2S)-3-(4-hydroxy-3-iodophenyl)-2-[(2-methylpropan-2-yl)oxycarbonylamino]propanoate
InChI:
InChI=1S/C18H21IN2O7/c1-18(2,3)27-17(26)20-12(9-10-4-5-13(22)11(19)8-10)16(25)28-21-14(23)6-7-15(21)24/h4-5,8,12,22H,6-7,9H2,1-3H3,(H,20,26)/t12-/m0/s1
InChI Key:
ZSHWOTBCGGDEQO-LBPRGKRZSA-N
Properties
Complexity:
618
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
1
Defined Bond Stereocenter Count:
0
Exact Mass:
504.039g/mol
Formal Charge:
0
Heavy Atom Count:
28
Hydrogen Bond Acceptor Count:
7
Hydrogen Bond Donor Count:
2
Isotope Atom Count:
0
Molecular Weight:
504.277g/mol
Monoisotopic Mass:
504.039g/mol
Rotatable Bond Count:
8
Topological Polar Surface Area:
122A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
2.2
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