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1334172-73-4 | alpha-Lipoamide-omega-maleimido undeca(ethylene glycol)
CAS No: 1334172-73-4 Catalog No: AG00HSWK MDL No:
Product Description
Catalog Number:
AG00HSWK
Chemical Name:
alpha-Lipoamide-omega-maleimido undeca(ethylene glycol)
CAS Number:
1334172-73-4
Molecular Formula:
C39H78N3O15S2
Molecular Weight:
893.1777
IUPAC Name:
N-[2-[2-[2-[2-[2-[2-[2-[2-[2-[2-[2-[2-[3-(2,5-dioxopyrrol-1-yl)propanoylamino]ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethyl]-5-(dithiolan-3-yl)pentanamide
InChI:
InChI=1S/C39H69N3O15S2/c43-36(4-2-1-3-35-8-34-58-59-35)40-9-12-47-14-16-49-18-20-51-22-24-53-26-28-55-30-32-57-33-31-56-29-27-54-25-23-52-21-19-50-17-15-48-13-10-41-37(44)7-11-42-38(45)5-6-39(42)46/h5-6,35H,1-4,7-34H2,(H,40,43)(H,41,44)
InChI Key:
MCLHFRMIEQEYEN-UHFFFAOYSA-N
SMILES:
OCC[N](C(=O)CCCCC1SSCC1)(CCOCCNC(=O)CCN1C(=O)C=CC1=O)(CCO)(CCO)(CCO)(CCO)(CCO)(CCO)(CCO)(CCO)CCO
Properties
Complexity:
1080
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
883.417g/mol
Formal Charge:
0
Heavy Atom Count:
59
Hydrogen Bond Acceptor Count:
17
Hydrogen Bond Donor Count:
2
Isotope Atom Count:
0
Molecular Weight:
884.107g/mol
Monoisotopic Mass:
883.417g/mol
Rotatable Bond Count:
44
Topological Polar Surface Area:
248A^2
Undefined Atom Stereocenter Count:
1
Undefined Bond Stereocenter Count:
0
XLogP3:
-1.7
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