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557756-85-1

557756-85-1 | 5,8,11,14-Tetraoxa-2-azaheptadecanedioic acid 1-(9H-fluoren-9-ylmethyl) ester

CAS No: 557756-85-1 Catalog No: AG0038NB MDL No:MFCD06656472

Product Description

Catalog Number:
AG0038NB
Chemical Name:
5,8,11,14-Tetraoxa-2-azaheptadecanedioic acid 1-(9H-fluoren-9-ylmethyl) ester
CAS Number:
557756-85-1
Molecular Formula:
C26H33NO8
Molecular Weight:
487.5421
MDL Number:
MFCD06656472
IUPAC Name:
3-[2-[2-[2-[2-(9H-fluoren-9-ylmethoxycarbonylamino)ethoxy]ethoxy]ethoxy]ethoxy]propanoic acid
InChI:
InChI=1S/C26H33NO8/c28-25(29)9-11-31-13-15-33-17-18-34-16-14-32-12-10-27-26(30)35-19-24-22-7-3-1-5-20(22)21-6-2-4-8-23(21)24/h1-8,24H,9-19H2,(H,27,30)(H,28,29)
InChI Key:
NUHRPLKTAAVHCZ-UHFFFAOYSA-N
SMILES:
OC(=O)CCOCCOCCOCCOCCNC(=O)OCC1c2ccccc2c2c1cccc2

Properties

Complexity:
596  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
487.221g/mol
Formal Charge:
0
Heavy Atom Count:
35  
Hydrogen Bond Acceptor Count:
8  
Hydrogen Bond Donor Count:
2  
Isotope Atom Count:
0
Molecular Weight:
487.549g/mol
Monoisotopic Mass:
487.221g/mol
Rotatable Bond Count:
18  
Topological Polar Surface Area:
113A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
2  

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