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1609659-01-9

1609659-01-9 | trans-Cyclooctene-PEG(3)-maleimide

CAS No: 1609659-01-9 Catalog No: AG00VRMG MDL No:

Product Description

Catalog Number:
AG00VRMG
Chemical Name:
trans-Cyclooctene-PEG(3)-maleimide
CAS Number:
1609659-01-9
Molecular Formula:
C26H41N3O8
Molecular Weight:
523.6190
IUPAC Name:
[(4Z)-cyclooct-4-en-1-yl] N-[3-[2-[2-[3-[3-(2,5-dioxopyrrol-1-yl)propanoylamino]propoxy]ethoxy]ethoxy]propyl]carbamate
InChI:
InChI=1S/C26H41N3O8/c30-23(12-15-29-24(31)10-11-25(29)32)27-13-6-16-34-18-20-36-21-19-35-17-7-14-28-26(33)37-22-8-4-2-1-3-5-9-22/h1-2,10-11,22H,3-9,12-21H2,(H,27,30)(H,28,33)/b2-1-
InChI Key:
BJZRPWAVCDJCTC-UPHRSURJSA-N
SMILES:
O=C(OC1CCCC=CCC1)NCCCOCCOCCOCCCNC(=O)CCN1C(=O)C=CC1=O

Properties

Complexity:
753  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
1  
Exact Mass:
523.289g/mol
Formal Charge:
0
Heavy Atom Count:
37  
Hydrogen Bond Acceptor Count:
8  
Hydrogen Bond Donor Count:
2  
Isotope Atom Count:
0
Molecular Weight:
523.627g/mol
Monoisotopic Mass:
523.289g/mol
Rotatable Bond Count:
19  
Topological Polar Surface Area:
133A^2
Undefined Atom Stereocenter Count:
1  
Undefined Bond Stereocenter Count:
0
XLogP3:
1  

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