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1263045-16-4 | Mal-Amido-PEG4-acid
CAS No: 1263045-16-4 Catalog No: AG009GMF MDL No:MFCD13184954
Product Description
Catalog Number:
AG009GMF
Chemical Name:
Mal-Amido-PEG4-acid
CAS Number:
1263045-16-4
Molecular Formula:
C18H28N2O9
Molecular Weight:
416.4229
MDL Number:
MFCD13184954
IUPAC Name:
3-[2-[2-[2-[2-[3-(2,5-dioxopyrrol-1-yl)propanoylamino]ethoxy]ethoxy]ethoxy]ethoxy]propanoic acid
InChI:
InChI=1S/C18H28N2O9/c21-15(3-6-20-16(22)1-2-17(20)23)19-5-8-27-10-12-29-14-13-28-11-9-26-7-4-18(24)25/h1-2H,3-14H2,(H,19,21)(H,24,25)
InChI Key:
IAJVEYLYYHOZEY-UHFFFAOYSA-N
SMILES:
O=C(CCN1C(=O)C=CC1=O)NCCOCCOCCOCCOCCC(=O)O
Properties
Complexity:
548
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
416.179g/mol
Formal Charge:
0
Heavy Atom Count:
29
Hydrogen Bond Acceptor Count:
9
Hydrogen Bond Donor Count:
2
Isotope Atom Count:
0
Molecular Weight:
416.427g/mol
Monoisotopic Mass:
416.179g/mol
Rotatable Bond Count:
18
Topological Polar Surface Area:
141A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
-1.3
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