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Gly-PEG3-amine, TFA salt

CAT: 0127-BIPG2426-01Size: 50 mgDry Ice: NoHazardous: No
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CAT#:0127-BIPG2426-01Size:50 mg
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24/48H Stock Items & 2 to 6 Weeks non Stock Items.
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CAS Number
2110448-97-8
Purity
98%
Smiles
C (CN) COCCOCCOCCCNC (=O) CN

Chemical Information

Gly-PEG3-amine
CAS Number2110448-97-8
PubChem CID123586963
IUPAC Name2-amino-N-[3-[2-[2-(3-aminopropoxy)ethoxy]ethoxy]propyl]acetamide
Molecular FormulaC12H27N3O4
Molecular Weight277.36
XLogP-2
Topological Polar Surface Area109
Hydrogen Bond Donor Count3
Hydrogen Bond Acceptor Count6
Rotatable Bond Count14
Heavy Atom Count19
Formal Charge0
Complexity205
SMILES
C(CN)COCCOCCOCCCNC(=O)CN
InChI
InChI=1S/C12H27N3O4/c13-3-1-5-17-7-9-19-10-8-18-6-2-4-15-12(16)11-14/h1-11,13-14H2,(H,15,16)
InChIKey
MJIUWBANJNMPMX-UHFFFAOYSA-N
Chemical Structure
2D Structure
2D structure of Gly-PEG3-amine
CAS: 2110448-97-8
CID: 123586963
Formula: C12H27N3O4
MW: 277.36
Interactive 3D Structure
Loading 3D structure...
Computed Properties
PropertyValue
Molecular Weight277.36
XLogP3-2
Hydrogen Bond Donor Count3
Hydrogen Bond Acceptor Count6
Rotatable Bond Count14
Exact Mass277.20015635
Monoisotopic Mass277.20015635
Topological Polar Surface Area109 Ų
Heavy Atom Count19
Formal Charge0
Complexity205
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