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Boc-NH-C4-acid

CAT: 0013-GTR19216805Size: 1 gDry Ice: NoHazardous: No
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CAT#:0013-GTR19216805Size:1 g
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Description
Boc-NH-C4-acid is a PROTAC linker, which belongs to an Alkyl/ether linker.
CAS Number
27219-07-4
Purity
>98% (HPLC)
Solubility
In Vitro: DMSO : 100 mg/mL (460.28 mM)
Smiles
CC (C) (C) OC (=O) NCCCCC (O) =O
Molecular Formula
C10H19NO4
Molecular Weight
217.265
Storage Conditions
Storage temperature: -20°C. Stability: ≥ 2 years
Notes
For research use only.

Chemical Information

5-(((Tert-butoxy)carbonyl)amino)pentanoic acid
CAS Number27219-07-4
PubChem CID545848
IUPAC Name5-[(2-methylpropan-2-yl)oxycarbonylamino]pentanoic acid
Molecular FormulaC10H19NO4
Molecular Weight217.26
XLogP1.1
Topological Polar Surface Area75.6
Hydrogen Bond Donor Count2
Hydrogen Bond Acceptor Count4
Rotatable Bond Count7
Heavy Atom Count15
Formal Charge0
Complexity220
SMILES
CC(C)(C)OC(=O)NCCCCC(=O)O
InChI
InChI=1S/C10H19NO4/c1-10(2,3)15-9(14)11-7-5-4-6-8(12)13/h4-7H2,1-3H3,(H,11,14)(H,12,13)
InChIKey
GFMRZAMDGJIWRB-UHFFFAOYSA-N
Chemical Structure
2D Structure
2D structure of 5-(((Tert-butoxy)carbonyl)amino)pentanoic acid
CAS: 27219-07-4
CID: 545848
Formula: C10H19NO4
MW: 217.26
Interactive 3D Structure
Loading 3D structure...
Computed Properties
PropertyValue
Molecular Weight217.26
XLogP31.1
Hydrogen Bond Donor Count2
Hydrogen Bond Acceptor Count4
Rotatable Bond Count7
Exact Mass217.13140809
Monoisotopic Mass217.13140809
Topological Polar Surface Area75.6 Ų
Heavy Atom Count15
Formal Charge0
Complexity220
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