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Amino-PEG10-acid

CAT: 0127-BUP05678-01Size: 5 mgDry Ice: NoHazardous: No
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CAT#:0127-BUP05678-01Size:5 mg
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24/48H Stock Items & 2 to 6 Weeks non Stock Items.
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CAS Number
2170987-85-4
Purity
=98%
Smiles
C(OCCOCCOCCOCCOCCOCCOCCN)COCCOCCOCCC(O)=O

Chemical Information

Amino-PEG10-acid
CAS Number2170987-85-4
PubChem CID77078362
IUPAC Name3-[2-[2-[2-[2-[2-[2-[2-[2-[2-(2-aminoethoxy)ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]propanoic acid
Molecular FormulaC23H47NO12
Molecular Weight529.6
XLogP-5
Topological Polar Surface Area156
Hydrogen Bond Donor Count2
Hydrogen Bond Acceptor Count13
Rotatable Bond Count32
Heavy Atom Count36
Formal Charge0
Complexity434
SMILES
C(COCCOCCOCCOCCOCCOCCOCCOCCOCCOCCN)C(=O)O
InChI
InChI=1S/C23H47NO12/c24-2-4-28-6-8-30-10-12-32-14-16-34-18-20-36-22-21-35-19-17-33-15-13-31-11-9-29-7-5-27-3-1-23(25)26/h1-22,24H2,(H,25,26)
InChIKey
SVXUSQJNNODUGC-UHFFFAOYSA-N
Chemical Structure
2D Structure
2D structure of Amino-PEG10-acid
CAS: 2170987-85-4
CID: 77078362
Formula: C23H47NO12
MW: 529.6
Interactive 3D Structure
Loading 3D structure...
Computed Properties
PropertyValue
Molecular Weight529.6
XLogP3-5
Hydrogen Bond Donor Count2
Hydrogen Bond Acceptor Count13
Rotatable Bond Count32
Exact Mass529.30982593
Monoisotopic Mass529.30982593
Topological Polar Surface Area156 Ų
Heavy Atom Count36
Formal Charge0
Complexity434
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