339221-91-9,MFCD28047484
Catalog No.:AA00CKZ1

339221-91-9 | Fluo-3, pentaammonium salt

Pack Size
Purity
Availability
Price(USD)
Quantity
  
1mg
≥90%
in stock  
$279.00   $195.00
- +
  • Technical Information
  • Properties
  • Literature
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Technical Information
Catalog Number:
AA00CKZ1
Chemical Name:
Fluo-3, pentaammonium salt
CAS Number:
339221-91-9
Molecular Formula:
C36H45Cl2N7O13
Molecular Weight:
854.6876
MDL Number:
MFCD28047484
SMILES:
[O-]C(=O)CN(c1ccc(cc1OCCOc1cc(C)ccc1N(CC(=O)[O-])CC(=O)[O-])c1c2cc(Cl)c(=O)cc2oc2c1cc(Cl)c(c2)[O-])CC(=O)[O-].[NH4+].[NH4+].[NH4+].[NH4+].[NH4+]
Properties
Computed Properties
 
Complexity:
1420  
Covalently-Bonded Unit Count:
6  
Defined Atom Stereocenter Count:
0  
Defined Bond Stereocenter Count:
0  
Formal Charge:
0  
Heavy Atom Count:
58  
Hydrogen Bond Acceptor Count:
15  
Hydrogen Bond Donor Count:
5  
Isotope Atom Count:
0  
Rotatable Bond Count:
12  
Undefined Atom Stereocenter Count:
0  
Undefined Bond Stereocenter Count:
0  

Literature
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SDS
Tags:339221-91-9 Molecular Formula|339221-91-9 MDL|339221-91-9 SMILES|339221-91-9 Fluo-3, pentaammonium salt
Catalog No.: AA00CKZ1
339221-91-9,MFCD28047484
339221-91-9 | Fluo-3, pentaammonium salt
Pack Size: 1mg
Purity: ≥90%
in stock
$279.00 $195.00
Quantity
- +
Add to Card
Order Now
bulk Quotation Request
Technical Information
Catalog Number: AA00CKZ1
Chemical Name: Fluo-3, pentaammonium salt
CAS Number: 339221-91-9
Molecular Formula: C36H45Cl2N7O13
Molecular Weight: 854.6876
MDL Number: MFCD28047484
SMILES: [O-]C(=O)CN(c1ccc(cc1OCCOc1cc(C)ccc1N(CC(=O)[O-])CC(=O)[O-])c1c2cc(Cl)c(=O)cc2oc2c1cc(Cl)c(c2)[O-])CC(=O)[O-].[NH4+].[NH4+].[NH4+].[NH4+].[NH4+]
Properties
Complexity: 1420  
Covalently-Bonded Unit Count: 6  
Defined Atom Stereocenter Count: 0  
Defined Bond Stereocenter Count: 0  
Formal Charge: 0  
Heavy Atom Count: 58  
Hydrogen Bond Acceptor Count: 15  
Hydrogen Bond Donor Count: 5  
Isotope Atom Count: 0  
Rotatable Bond Count: 12  
Undefined Atom Stereocenter Count: 0  
Undefined Bond Stereocenter Count: 0  
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