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Amino-PEG3-C2-Azido

CAT: 0572-TRC-A585000-10GSize: 10 gDry Ice: NoHazardous: Yes
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CAT#:0572-TRC-A585000-10GSize:10 g
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24/48H Stock Items & 2 to 6 Weeks non Stock Items.
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CAS Number
134179-38-7
Synonyms
1-Amino-11-azido-3,6,9-trioxaundecane
Hazard Statement
Causes severe skin burns and eye damage; UN number: UN2735; Packing Group: II
Smiles
NCCOCCOCCOCCN=[N+]=[N-]
Molecular Formula
C8 H18 N4 O3
Molecular Weight
218.25
InChI
InChI=1S/C8H18N4O3/c9-1-3-13-5-7-15-8-6-14-4-2-11-12-10/h1-9H2
Additionnal Information
IUPAC name: 2-[2-[2-(2-azidoethoxy)ethoxy]ethoxy]ethanamine
Shipping Conditions
Room Temperature
Storage Conditions
+4°C

Chemical Information

1-Amino-11-azido-3,6,9-trioxaundecane
CAS Number134179-38-7
PubChem CID2735280
IUPAC Name2-[2-[2-(2-azidoethoxy)ethoxy]ethoxy]ethanamine
Molecular FormulaC8H18N4O3
Molecular Weight218.25
XLogP-0.3
Topological Polar Surface Area68.1
Hydrogen Bond Donor Count1
Hydrogen Bond Acceptor Count6
Rotatable Bond Count11
Heavy Atom Count15
Formal Charge0
Complexity173
SMILES
C(COCCOCCOCCN=[N+]=[N-])N
InChI
InChI=1S/C8H18N4O3/c9-1-3-13-5-7-15-8-6-14-4-2-11-12-10/h1-9H2
InChIKey
FPVCVHVTMPCZTH-UHFFFAOYSA-N
Chemical Structure
2D Structure
2D structure of 1-Amino-11-azido-3,6,9-trioxaundecane
CAS: 134179-38-7
CID: 2735280
Formula: C8H18N4O3
MW: 218.25
Interactive 3D Structure
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View on PubChemRaw 3D data
Computed Properties
PropertyValue
Molecular Weight218.25
XLogP3-0.3
Hydrogen Bond Donor Count1
Hydrogen Bond Acceptor Count6
Rotatable Bond Count11
Exact Mass218.13789045
Monoisotopic Mass218.13789045
Topological Polar Surface Area68.1 Ų
Heavy Atom Count15
Formal Charge0
Complexity173
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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GTR19226751-01Amino-PEG3-C2-Azido
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