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DTNB-NHS

CAS No.:
60129-38-6
Catalog Number:
AG00EBGC
Molecular Formula:
Molecular Weight:
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Product Description
Catalog Number:
AG00EBGC
Chemical Name:
DTNB-NHS
CAS Number:
60129-38-6
MDL Number:
MFCD00467474
IUPAC Name:
(2,5-dioxopyrrolidin-1-yl) 5-[[3-(2,5-dioxopyrrolidin-1-yl)oxycarbonyl-4-nitrophenyl]disulfanyl]-2-nitrobenzoate
InChI:
InChI=1S/C22H14N4O12S2/c27-17-5-6-18(28)23(17)37-21(31)13-9-11(1-3-15(13)25(33)34)39-40-12-2-4-16(26(35)36)14(10-12)22(32)38-24-19(29)7-8-20(24)30/h1-4,9-10H,5-8H2
InChI Key:
WQAKOGSBRWFFLW-UHFFFAOYSA-N
Properties
Complexity:
1010  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
590.005g/mol
Formal Charge:
0
Heavy Atom Count:
40  
Hydrogen Bond Acceptor Count:
14  
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
590.49g/mol
Monoisotopic Mass:
590.005g/mol
Rotatable Bond Count:
9  
Topological Polar Surface Area:
270A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
1.6  
Properties