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11-Mercaptoundecanoate-NHS

CAT: 0013-GTR19253475-01Size: 50 mgDry Ice: NoHazardous: No
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CAT#:0013-GTR19253475-01Size:50 mg
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Description
11-Mercaptoundecanoate-NHS is a lipid utilized in the synthesis of Linkers.
CAS Number
240125-70-6
Field of Research
Metabolism Research
Smiles
O=C (ON1C (=O) CCC1=O) CCCCCCCCCCS
Molecular Formula
C15H25NO4S
Molecular Weight
315.428
Storage Conditions
-20°C
Notes
For research use only.

Chemical Information

2,5-Dioxopyrrolidin-1-yl 11-mercaptoundecanoate
CAS Number240125-70-6
PubChem CID16049984
IUPAC Name(2,5-dioxopyrrolidin-1-yl) 11-sulfanylundecanoate
Molecular FormulaC15H25NO4S
Molecular Weight315.4
XLogP3.2
Topological Polar Surface Area64.7
Hydrogen Bond Donor Count1
Hydrogen Bond Acceptor Count5
Rotatable Bond Count12
Heavy Atom Count21
Formal Charge0
Complexity344
SMILES
C1CC(=O)N(C1=O)OC(=O)CCCCCCCCCCS
InChI
InChI=1S/C15H25NO4S/c17-13-10-11-14(18)16(13)20-15(19)9-7-5-3-1-2-4-6-8-12-21/h21H,1-12H2
InChIKey
JPXQEYQKZFROQX-UHFFFAOYSA-N
Chemical Structure
2D Structure
2D structure of 2,5-Dioxopyrrolidin-1-yl 11-mercaptoundecanoate
CAS: 240125-70-6
CID: 16049984
Formula: C15H25NO4S
MW: 315.4
Interactive 3D Structure
Loading 3D structure...
View on PubChemRaw 3D data
Computed Properties
PropertyValue
Molecular Weight315.4
XLogP33.2
Hydrogen Bond Donor Count1
Hydrogen Bond Acceptor Count5
Rotatable Bond Count12
Exact Mass315.15042945
Monoisotopic Mass315.15042945
Topological Polar Surface Area64.7 Ų
Heavy Atom Count21
Formal Charge0
Complexity344
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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