Home Other Building Blocks Bis(acetoxymethyl) 3,12-bis(2-(acetoxymethoxy)-2-oxoethyl)-6,9-dioxa-3,12-diazatetradecane-1,14-dioate

Bis(acetoxymethyl) 3,12-bis(2-(acetoxymethoxy)-2-oxoethyl)-6,9-dioxa-3,12-diazatetradecane-1,14-dioate

CAS No.:
99590-86-0
Catalog Number:
AG0064WJ
Molecular Formula:
C26H40N2O18
Molecular Weight:
668.5984
Pack Size
Purity
Availability
Location
Price(USD)
Quantity
  
10mg
≥90%
1 week
United States
$397
- +
Product Description
Catalog Number:
AG0064WJ
Chemical Name:
Bis(acetoxymethyl) 3,12-bis(2-(acetoxymethoxy)-2-oxoethyl)-6,9-dioxa-3,12-diazatetradecane-1,14-dioate
CAS Number:
99590-86-0
Molecular Formula:
C26H40N2O18
Molecular Weight:
668.5984
MDL Number:
MFCD00077339
IUPAC Name:
acetyloxymethyl 2-[[2-(acetyloxymethoxy)-2-oxoethyl]-[2-[2-[2-[bis[2-(acetyloxymethoxy)-2-oxoethyl]amino]ethoxy]ethoxy]ethyl]amino]acetate
InChI:
InChI=1S/C26H40N2O18/c1-19(29)39-15-43-23(33)11-27(12-24(34)44-16-40-20(2)30)5-7-37-9-10-38-8-6-28(13-25(35)45-17-41-21(3)31)14-26(36)46-18-42-22(4)32/h5-18H2,1-4H3
InChI Key:
GNJXVFXIDHCCKR-UHFFFAOYSA-N
SMILES:
O=C(CN(CC(=O)OCOC(=O)C)CCOCCOCCN(CC(=O)OCOC(=O)C)CC(=O)OCOC(=O)C)OCOC(=O)C
Properties
Complexity:
857  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
668.228g/mol
Formal Charge:
0
Heavy Atom Count:
46  
Hydrogen Bond Acceptor Count:
20  
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
668.602g/mol
Monoisotopic Mass:
668.228g/mol
Rotatable Bond Count:
33  
Topological Polar Surface Area:
235A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
-0.4  
Literature
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Properties