468095-63-8,MFCD06797177
Catalog No.:AA003FB6

468095-63-8 | S-4-(Trifluoromethyl)benzyl O-((2R,3R,4S,5R,6R)-3,4,5-tris(benzyloxy)-6-((benzyloxy)methyl)tetrahydro-2H-pyran-2-yl) (4-(trifluoromethyl)phenyl)carbonimidothioate

Pack Size
Purity
Availability
Price(USD)
Quantity
  
250mg
2 weeks  
$403.00   $282.00
- +
1g
2 weeks  
$1,072.00   $750.00
- +
  • Technical Information
  • Properties
  • Literature
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Technical Information
Catalog Number:
AA003FB6
Chemical Name:
S-4-(Trifluoromethyl)benzyl O-((2R,3R,4S,5R,6R)-3,4,5-tris(benzyloxy)-6-((benzyloxy)methyl)tetrahydro-2H-pyran-2-yl) (4-(trifluoromethyl)phenyl)carbonimidothioate
CAS Number:
468095-63-8
Molecular Formula:
C50H45F6NO6S
Molecular Weight:
901.9508
MDL Number:
MFCD06797177
SMILES:
FC(c1ccc(cc1)/N=C(/O[C@H]1O[C@H](COCc2ccccc2)[C@H]([C@@H]([C@H]1OCc1ccccc1)OCc1ccccc1)OCc1ccccc1)\SCc1ccc(cc1)C(F)(F)F)(F)F
Properties
Properties
 
Form:
Solid  
MP:
120.0 to 125.0℃  
Storage:
-20 ℃;  

Computed Properties
 
Complexity:
1330  
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
5  
Defined Bond Stereocenter Count:
0  
Formal Charge:
0  
Heavy Atom Count:
64  
Hydrogen Bond Acceptor Count:
14  
Hydrogen Bond Donor Count:
0  
Isotope Atom Count:
0  
Rotatable Bond Count:
19  
Undefined Atom Stereocenter Count:
0  
Undefined Bond Stereocenter Count:
0  
XLogP3:
11.6  

Literature
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SDS
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Tags:468095-63-8 Molecular Formula|468095-63-8 MDL|468095-63-8 SMILES|468095-63-8 S-4-(Trifluoromethyl)benzyl O-((2R,3R,4S,5R,6R)-3,4,5-tris(benzyloxy)-6-((benzyloxy)methyl)tetrahydro-2H-pyran-2-yl) (4-(trifluoromethyl)phenyl)carbonimidothioate
Catalog No.: AA003FB6
468095-63-8,MFCD06797177
468095-63-8 | S-4-(Trifluoromethyl)benzyl O-((2R,3R,4S,5R,6R)-3,4,5-tris(benzyloxy)-6-((benzyloxy)methyl)tetrahydro-2H-pyran-2-yl) (4-(trifluoromethyl)phenyl)carbonimidothioate
Pack Size: 250mg
Purity:
2 weeks
$403.00 $282.00
Pack Size: 1g
Purity:
2 weeks
$1,072.00 $750.00
Quantity
- +
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bulk Quotation Request
Technical Information
Catalog Number: AA003FB6
Chemical Name: S-4-(Trifluoromethyl)benzyl O-((2R,3R,4S,5R,6R)-3,4,5-tris(benzyloxy)-6-((benzyloxy)methyl)tetrahydro-2H-pyran-2-yl) (4-(trifluoromethyl)phenyl)carbonimidothioate
CAS Number: 468095-63-8
Molecular Formula: C50H45F6NO6S
Molecular Weight: 901.9508
MDL Number: MFCD06797177
SMILES: FC(c1ccc(cc1)/N=C(/O[C@H]1O[C@H](COCc2ccccc2)[C@H]([C@@H]([C@H]1OCc1ccccc1)OCc1ccccc1)OCc1ccccc1)\SCc1ccc(cc1)C(F)(F)F)(F)F
Properties
Form: Solid  
MP: 120.0 to 125.0℃  
Storage: -20 ℃;  
Complexity: 1330  
Covalently-Bonded Unit Count: 1  
Defined Atom Stereocenter Count: 5  
Defined Bond Stereocenter Count: 0  
Formal Charge: 0  
Heavy Atom Count: 64  
Hydrogen Bond Acceptor Count: 14  
Hydrogen Bond Donor Count: 0  
Isotope Atom Count: 0  
Rotatable Bond Count: 19  
Undefined Atom Stereocenter Count: 0  
Undefined Bond Stereocenter Count: 0  
XLogP3: 11.6  
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