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1334169-99-1 | alpha-Maleimido-omega-(t-butyloxycarbonylhydrazidopropionate) dodeca(ethylene glycol)
CAS No: 1334169-99-1 Catalog No: AG00VR4H MDL No:
Product Description
Catalog Number:
AG00VR4H
Chemical Name:
alpha-Maleimido-omega-(t-butyloxycarbonylhydrazidopropionate) dodeca(ethylene glycol)
CAS Number:
1334169-99-1
Molecular Formula:
C39H70N4O18
Molecular Weight:
882.9891
IUPAC Name:
tert-butyl N-[3-[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]ethoxy]propanoylamino]carbamate
InChI:
InChI=1S/C39H70N4O18/c1-39(2,3)61-38(48)42-41-35(45)7-10-49-12-14-51-16-18-53-20-22-55-24-26-57-28-30-59-32-33-60-31-29-58-27-25-56-23-21-54-19-17-52-15-13-50-11-8-40-34(44)6-9-43-36(46)4-5-37(43)47/h4-5H,6-33H2,1-3H3,(H,40,44)(H,41,45)(H,42,48)
InChI Key:
BBYHTOQZUQBMCS-UHFFFAOYSA-N
SMILES:
O=C(NNC(=O)OC(C)(C)C)CCOCCOCCOCCOCCOCCOCCOCCOCCOCCOCCOCCOCCNC(=O)CCN1C(=O)C=CC1=O
Properties
Complexity:
1160
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
882.469g/mol
Formal Charge:
0
Heavy Atom Count:
61
Hydrogen Bond Acceptor Count:
18
Hydrogen Bond Donor Count:
3
Isotope Atom Count:
0
Molecular Weight:
882.999g/mol
Monoisotopic Mass:
882.469g/mol
Rotatable Bond Count:
44
Topological Polar Surface Area:
245A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
-2.9
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