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DACN (Tos, Suc-NHS)

CAT: 0013-GTR19237639-01Size: 10 mgDry Ice: NoHazardous: No
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CAT#:0013-GTR19237639-01Size:10 mg
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Description
DACN (Tos, Suc-NHS) is a cycloalkyne-containing reagent designed for copper-free click chemistry applications. It is widely used for bioconjugation in proteomics and cellular imaging studies, facilitating the labeling of biomolecules in both in vitro and in vivo experimental settings.
CAS Number
2411082-26-1
Smiles
O=C (ON1C (=O) CCC1=O) CCC (=O) N2CC#CCN (CCC2) S (=O) (=O) C3=CC=C (C=C3) C
Molecular Formula
C22H25N3O7S
Molecular Weight
475.52
Storage Conditions
-20°C
Notes
For research use only.

Chemical Information

DACN(Tos,Suc-NHS)
CAS Number2411082-26-1
PubChem CID162421314
IUPAC Name(2,5-dioxopyrrolidin-1-yl) 4-[5-(4-methylphenyl)sulfonyl-1,5-diazacyclonon-7-yn-1-yl]-4-oxobutanoate
Molecular FormulaC22H25N3O7S
Molecular Weight475.5
XLogP0
Topological Polar Surface Area130
Hydrogen Bond Donor Count0
Hydrogen Bond Acceptor Count8
Rotatable Bond Count7
Heavy Atom Count33
Formal Charge0
Complexity935
SMILES
CC1=CC=C(C=C1)S(=O)(=O)N2CCCN(CC#CC2)C(=O)CCC(=O)ON3C(=O)CCC3=O
InChI
InChI=1S/C22H25N3O7S/c1-17-5-7-18(8-6-17)33(30,31)24-15-3-2-13-23(14-4-16-24)19(26)11-12-22(29)32-25-20(27)9-10-21(25)28/h5-8H,4,9-16H2,1H3
InChIKey
MLMHCPCWLSQNMB-UHFFFAOYSA-N
Chemical Structure
2D Structure
2D structure of DACN(Tos,Suc-NHS)
CAS: 2411082-26-1
CID: 162421314
Formula: C22H25N3O7S
MW: 475.5
Interactive 3D Structure
Loading 3D structure...
View on PubChemRaw 3D data
Computed Properties
PropertyValue
Molecular Weight475.5
XLogP30
Hydrogen Bond Donor Count0
Hydrogen Bond Acceptor Count8
Rotatable Bond Count7
Exact Mass475.14132132
Monoisotopic Mass475.14132132
Topological Polar Surface Area130 Ų
Heavy Atom Count33
Formal Charge0
Complexity935
Isotope Atom Count0
Defined Atom Stereocenter Count0
Undefined Atom Stereocenter Count0
Defined Bond Stereocenter Count0
Undefined Bond Stereocenter Count0
Covalently-Bonded Unit Count1
Compound Is CanonicalizedYes

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Alternative Products

CatalogName
T89717-01DACN (Tos, Suc-NHS)
HY-151770DACN(Tos,Suc-NHS)
HY-151766DACN (Tos, Suc-OH)
T89744-01DACN (Tos, Ns)
HY-151795DACN (Tos) (hydrochloride)
T87927-01DACN (Tos, Mal)
T89724-01DACN (Tos) hydrochloride
T89743-01DACN (Tos2)
HY-151794DACN (Ms) (hydrochloride)
T89824-01DACN (Ms) hydrochloride

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