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CAT: 0607-BA2428-100Size: 100 mgDry Ice: NoHazardous: No
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CAT#:0607-BA2428-100Size:100 mg
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CAS Number
341498-08-6
Form
A solid
Molecular Formula
C14H16N2O4S2
Molecular Weight
340.42
Shipping Conditions
Blue ice
Storage Conditions
-20°C.

Chemical Information

N-succinimidyl 4-(2-pyridyldithio)pentanoate

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CAS Number341498-08-6
PubChem CID11588139
IUPAC Name(2,5-dioxopyrrolidin-1-yl) 4-(pyridin-2-yldisulfanyl)pentanoate
Molecular FormulaC14H16N2O4S2
Molecular Weight340.4
XLogP1.5
Topological Polar Surface Area127
Hydrogen Bond Donor Count0
Hydrogen Bond Acceptor Count7
Rotatable Bond Count8
Heavy Atom Count22
Formal Charge0
Complexity417
SMILES
CC(CCC(=O)ON1C(=O)CCC1=O)SSC2=CC=CC=N2
InChI
InChI=1S/C14H16N2O4S2/c1-10(21-22-11-4-2-3-9-15-11)5-8-14(19)20-16-12(17)6-7-13(16)18/h2-4,9-10H,5-8H2,1H3
InChIKey
GTBCXYYVWHFQRS-UHFFFAOYSA-N
Chemical Structure
2D Structure
2D structure of N-succinimidyl 4-(2-pyridyldithio)pentanoate
CAS: 341498-08-6
CID: 11588139
Formula: C14H16N2O4S2
MW: 340.4
Interactive 3D Structure
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Computed Properties
PropertyValue
Molecular Weight340.4
XLogP31.5
Hydrogen Bond Donor Count0
Hydrogen Bond Acceptor Count7
Rotatable Bond Count8
Exact Mass340.05514934
Monoisotopic Mass340.05514934
Topological Polar Surface Area127 Ų
Heavy Atom Count22
Formal Charge0
Complexity417
Isotope Atom Count0
Defined Atom Stereocenter Count0
Undefined Atom Stereocenter Count1
Defined Bond Stereocenter Count0
Undefined Bond Stereocenter Count0
Covalently-Bonded Unit Count1
Compound Is CanonicalizedYes