67670-69-3,MFCD09702400
Catalog No.:AA006LCQ

67670-69-3 | N-Acetyl-2-chloro-2-deoxyneuraminic Acid Methyl Ester 4,7,8,9-Tetraacetate

Pack Size
Purity
Availability
Price(USD)
Quantity
  
25mg
95%
1 week  
$135.00   $95.00
- +
50mg
95%
1 week  
$228.00   $160.00
- +
100mg
95%
1 week  
$386.00   $270.00
- +
  • Technical Information
  • Properties
  • Downstream Synthesis Route
  • Literature
  • Request for Quotation
  • Download SDS
Technical Information
Catalog Number:
AA006LCQ
Chemical Name:
N-Acetyl-2-chloro-2-deoxyneuraminic Acid Methyl Ester 4,7,8,9-Tetraacetate
CAS Number:
67670-69-3
Molecular Formula:
C20H28ClNO12
Molecular Weight:
509.8888
MDL Number:
MFCD09702400
SMILES:
COC(=O)[C@]1(Cl)C[C@@H](OC(=O)C)[C@H](C(O1)[C@@H]([C@H](OC(=O)C)COC(=O)C)OC(=O)C)NC(=O)C
Properties
Properties
 
Form:
Solid  
MP:
104-106°C  
Storage:
-20 ℃;Keep in dry area;  

Computed Properties
 
Complexity:
817  
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
6  
Defined Bond Stereocenter Count:
0  
Formal Charge:
0  
Heavy Atom Count:
34  
Hydrogen Bond Acceptor Count:
12  
Hydrogen Bond Donor Count:
1  
Isotope Atom Count:
0  
Rotatable Bond Count:
14  
Undefined Atom Stereocenter Count:
0  
Undefined Bond Stereocenter Count:
0  
XLogP3:
1  

Downstream Synthesis Route
7295-76-3    67670-69-3   
N-methyl(5-acetamido-4,7,8,9-tetra-O-acetyl-3,5-dideoxy-D-glycero-α-D-galacto-non-2-ulopyranosyl)onate-3'-methoxypyridiniumtetrafluoroborate 

[1]Chou,DougT.H.;Watson,JacquelineN.;Scholte,AndrewA.;Borgford,ThorJ.;Bennet,AndrewJ.[JournaloftheAmericanChemicalSociety,2000,vol.122,#35,p.8357-8364]

57446-02-3    67670-69-3   
N-methyl(5-acetamido-4,7,8,9-tetra-O-acetyl-3,5-dideoxy-D-glycero-α-D-galacto-non-2-ulopyranosyl)onate-3',4'-dihydro-2'H-pyrano3',2'-cpyridiniumtetrafluoroborate 

[1]Knoll,TaraL.;Bennet,AndrewJ.[JournalofPhysicalOrganicChemistry,2004,vol.17,#6-7SPEC.ISS.,p.478-482]

[1]AngewandteChemie-InternationalEdition,2008,vol.47,p.2700-2703

[1]Sardzik,Robert;Sharma,Ritu;Kaloo,Sara;Voglmeir,Josef;Crocker,PaulR.;Flitsch,SabineL.[ChemicalCommunications,2011,vol.47,#19,p.5425-5427]

[2]CurrentPatentAssignee:UNIVERSITYOFCALIFORNIA-WO2020/163784,2020,A1Locationinpatent:Paragraph0009;0097-0098

[1]EuropeanJournalofMedicinalChemistry,2011,vol.46,p.2852-2860

Literature
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Additional Info:
SDS
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Tags:67670-69-3 Molecular Formula|67670-69-3 MDL|67670-69-3 SMILES|67670-69-3 N-Acetyl-2-chloro-2-deoxyneuraminic Acid Methyl Ester 4,7,8,9-Tetraacetate
Catalog No.: AA006LCQ
67670-69-3,MFCD09702400
67670-69-3 | N-Acetyl-2-chloro-2-deoxyneuraminic Acid Methyl Ester 4,7,8,9-Tetraacetate
Pack Size: 25mg
Purity: 95%
1 week
$135.00 $95.00
Pack Size: 50mg
Purity: 95%
1 week
$228.00 $160.00
Pack Size: 100mg
Purity: 95%
1 week
$386.00 $270.00
Quantity
- +
Add to Card
Order Now
bulk Quotation Request
Technical Information
Catalog Number: AA006LCQ
Chemical Name: N-Acetyl-2-chloro-2-deoxyneuraminic Acid Methyl Ester 4,7,8,9-Tetraacetate
CAS Number: 67670-69-3
Molecular Formula: C20H28ClNO12
Molecular Weight: 509.8888
MDL Number: MFCD09702400
SMILES: COC(=O)[C@]1(Cl)C[C@@H](OC(=O)C)[C@H](C(O1)[C@@H]([C@H](OC(=O)C)COC(=O)C)OC(=O)C)NC(=O)C
Properties
Form: Solid  
MP: 104-106°C  
Storage: -20 ℃;Keep in dry area;  
Complexity: 817  
Covalently-Bonded Unit Count: 1  
Defined Atom Stereocenter Count: 6  
Defined Bond Stereocenter Count: 0  
Formal Charge: 0  
Heavy Atom Count: 34  
Hydrogen Bond Acceptor Count: 12  
Hydrogen Bond Donor Count: 1  
Isotope Atom Count: 0  
Rotatable Bond Count: 14  
Undefined Atom Stereocenter Count: 0  
Undefined Bond Stereocenter Count: 0  
XLogP3: 1  
Downstream Synthesis Route
7295-76-3    67670-69-3   
N-methyl(5-acetamido-4,7,8,9-tetra-O-acetyl-3,5-dideoxy-D-glycero-α-D-galacto-non-2-ulopyranosyl)onate-3'-methoxypyridiniumtetrafluoroborate 

[1]Chou,DougT.H.;Watson,JacquelineN.;Scholte,AndrewA.;Borgford,ThorJ.;Bennet,AndrewJ.[JournaloftheAmericanChemicalSociety,2000,vol.122,#35,p.8357-8364]

57446-02-3    67670-69-3   
N-methyl(5-acetamido-4,7,8,9-tetra-O-acetyl-3,5-dideoxy-D-glycero-α-D-galacto-non-2-ulopyranosyl)onate-3',4'-dihydro-2'H-pyrano3',2'-cpyridiniumtetrafluoroborate 

[1]Knoll,TaraL.;Bennet,AndrewJ.[JournalofPhysicalOrganicChemistry,2004,vol.17,#6-7SPEC.ISS.,p.478-482]

575-03-1    67670-69-3    195210-09-4 

[1]AngewandteChemie-InternationalEdition,2008,vol.47,p.2700-2703

34637-22-4    67670-69-3    1311161-64-4 

[1]Sardzik,Robert;Sharma,Ritu;Kaloo,Sara;Voglmeir,Josef;Crocker,PaulR.;Flitsch,SabineL.[ChemicalCommunications,2011,vol.47,#19,p.5425-5427]

[2]CurrentPatentAssignee:UNIVERSITYOFCALIFORNIA-WO2020/163784,2020,A1Locationinpatent:Paragraph0009;0097-0098

131-48-6    67670-69-3 

[1]EuropeanJournalofMedicinalChemistry,2011,vol.46,p.2852-2860

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