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DiaAlk

CAT: 0013-GTR19224523-02Size: 5 mgDry Ice: NoHazardous: No
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CAT#:0013-GTR19224523-02Size:5 mg
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Description
DiaAlk is an electrophilic, clickable diazene probe designed for the site-specific capture and proteomic profiling of oxidative post-translational modifications (OxiPTMs) . It enables the identification of redox-sensitive cysteine residues in both in vitro and in vivo experimental settings, advancing research in redox biology and disease mechanisms.
CAS Number
2255307-83-4
Smiles
O=C (N=NC (=O) OC (C) (C) CCOCC#C) OC (C) (C) C
Molecular Formula
C14H22N2O5
Molecular Weight
298.34
Storage Conditions
-20°C
Notes
For research use only.

Chemical Information

(2-methyl-4-prop-2-ynoxybutan-2-yl) N-[(2-methylpropan-2-yl)oxycarbonylimino]carbamate
CAS Number2255307-83-4
PubChem CID164888197
IUPAC Name(2-methyl-4-prop-2-ynoxybutan-2-yl) N-[(2-methylpropan-2-yl)oxycarbonylimino]carbamate
Molecular FormulaC14H22N2O5
Molecular Weight298.33
XLogP2.9
Topological Polar Surface Area86.6
Hydrogen Bond Donor Count0
Hydrogen Bond Acceptor Count5
Rotatable Bond Count8
Heavy Atom Count21
Formal Charge0
Complexity440
SMILES
CC(C)(C)OC(=O)N=NC(=O)OC(C)(C)CCOCC#C
InChI
InChI=1S/C14H22N2O5/c1-7-9-19-10-8-14(5,6)21-12(18)16-15-11(17)20-13(2,3)4/h1H,8-10H2,2-6H3
InChIKey
XJQVERHFBNGDPW-UHFFFAOYSA-N
Chemical Structure
2D Structure
2D structure of (2-methyl-4-prop-2-ynoxybutan-2-yl) N-[(2-methylpropan-2-yl)oxycarbonylimino]carbamate
CAS: 2255307-83-4
CID: 164888197
Formula: C14H22N2O5
MW: 298.33
Interactive 3D Structure
Loading 3D structure...
View on PubChemRaw 3D data
Computed Properties
PropertyValue
Molecular Weight298.33
XLogP32.9
Hydrogen Bond Donor Count0
Hydrogen Bond Acceptor Count5
Rotatable Bond Count8
Exact Mass298.15287181
Monoisotopic Mass298.15287181
Topological Polar Surface Area86.6 Ų
Heavy Atom Count21
Formal Charge0
Complexity440
Isotope Atom Count0
Defined Atom Stereocenter Count0
Undefined Atom Stereocenter Count0
Defined Bond Stereocenter Count0
Undefined Bond Stereocenter Count1
Covalently-Bonded Unit Count1
Compound Is CanonicalizedYes

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