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Amino-PEG6-amine

CAT: 0804-HY-23105-01Size: 100 mgDry Ice: NoHazardous: No
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CAT#:0804-HY-23105-01Size:100 mg
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24/48H Stock Items & 2 to 6 Weeks non Stock Items.
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Description
Amino-PEG6-amine is a PEG-based (6 units) PROTAC linker can be used in the synthesis of PROTACs.
CAS Number
76927-70-3
UNSPSC
12352211
Hazard Statement
H314
Target
PROTAC Linkers
Type
Reference compound
Related Pathways
PROTAC
Applications
Cancer-programmed cell death
Field of Research
Cancer
Assay Protocol
https://www.medchemexpress.com/amino-peg7-amine.html
Purity
98.0
Solubility
DMSO : 100 mg/mL (ultrasonic)
Smiles
NCCOCCOCCOCCOCCOCCOCCN
Molecular Formula
C14H32N2O6
Molecular Weight
324.41
Precautions
H314
References & Citations
[1]Shan M, et al. Nonsteroidal bivalent estrogen ligands: an application of the bivalent concept to the estrogen receptor. ACS Chem Biol. 2013 Apr 19;8 (4) :707-15.
Shipping Conditions
Room Temperature
Storage Conditions
-20°C, 3 years; 4°C, 2 years (Powder)
Scientific Category
Reference compound1
Clinical Information
No Development Reported
Isoform
PEG Linkers

Chemical Information

Amino-PEG6-amine
CAS Number76927-70-3
PubChem CID21316316
IUPAC Name2-[2-[2-[2-[2-[2-(2-aminoethoxy)ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethanamine
Molecular FormulaC14H32N2O6
Molecular Weight324.41
XLogP-2.5
Topological Polar Surface Area107
Hydrogen Bond Donor Count2
Hydrogen Bond Acceptor Count8
Rotatable Bond Count19
Heavy Atom Count22
Formal Charge0
Complexity180
SMILES
C(COCCOCCOCCOCCOCCOCCN)N
InChI
InChI=1S/C14H32N2O6/c15-1-3-17-5-7-19-9-11-21-13-14-22-12-10-20-8-6-18-4-2-16/h1-16H2
InChIKey
SEBZAAOSFDHURG-UHFFFAOYSA-N
Chemical Structure
2D Structure
2D structure of Amino-PEG6-amine
CAS: 76927-70-3
CID: 21316316
Formula: C14H32N2O6
MW: 324.41
Interactive 3D Structure
Loading 3D structure...
View on PubChemRaw 3D data
Computed Properties
PropertyValue
Molecular Weight324.41
XLogP3-2.5
Hydrogen Bond Donor Count2
Hydrogen Bond Acceptor Count8
Rotatable Bond Count19
Exact Mass324.22603674
Monoisotopic Mass324.22603674
Topological Polar Surface Area107 Ų
Heavy Atom Count22
Formal Charge0
Complexity180
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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