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H2N-PEG8-CH2CH2COOH

CAT: 0926-FP73009-04Size: 1 gDry Ice: NoHazardous: No
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CAT#:0926-FP73009-04Size:1 g
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CAS Number
756526-04-2
Synonyms
27-Amino-4,7,10,13,16,19,22,25-octaoxaheptacosanoic acid; Amino-PEG8-propionic acid
MDL Number
MFCD11041146
Smiles
C (COCCOCCOCCOCCOCCOCCOCCOCCN) C (=O) O
Molecular Formula
C19H39NO10
Molecular Weight
441.51 g/mol
Shipping Conditions
Cool Pack
Controlled
No

Chemical Information

27-Amino-4,7,10,13,16,19,22,25-octaoxaheptacosanoic acid
CAS Number756526-04-2
PubChem CID51340929
IUPAC Name3-[2-[2-[2-[2-[2-[2-[2-(2-aminoethoxy)ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]propanoic acid
Molecular FormulaC19H39NO10
Molecular Weight441.5
XLogP-4.7
Topological Polar Surface Area137
Hydrogen Bond Donor Count2
Hydrogen Bond Acceptor Count11
Rotatable Bond Count26
Heavy Atom Count30
Formal Charge0
Complexity349
SMILES
C(COCCOCCOCCOCCOCCOCCOCCOCCN)C(=O)O
InChI
InChI=1S/C19H39NO10/c20-2-4-24-6-8-26-10-12-28-14-16-30-18-17-29-15-13-27-11-9-25-7-5-23-3-1-19(21)22/h1-18,20H2,(H,21,22)
InChIKey
YLKOHZCQTVYVDB-UHFFFAOYSA-N
Chemical Structure
2D Structure
2D structure of 27-Amino-4,7,10,13,16,19,22,25-octaoxaheptacosanoic acid
CAS: 756526-04-2
CID: 51340929
Formula: C19H39NO10
MW: 441.5
Interactive 3D Structure
Loading 3D structure...
View on PubChemRaw 3D data
Computed Properties
PropertyValue
Molecular Weight441.5
XLogP3-4.7
Hydrogen Bond Donor Count2
Hydrogen Bond Acceptor Count11
Rotatable Bond Count26
Exact Mass441.25739644
Monoisotopic Mass441.25739644
Topological Polar Surface Area137 Ų
Heavy Atom Count30
Formal Charge0
Complexity349
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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