177787-26-7,MFCD00083526
Catalog No.:AA0025GL

177787-26-7 | Benzoyl chloride, 3,4,5-trifluoro-

Pack Size
Purity
Availability
Price(USD)
Quantity
  
250mg
97%
in stock  
$86.00   $60.00
- +
1g
97%
in stock  
$141.00   $99.00
- +
5g
97%
in stock  
$432.00   $303.00
- +
25g
97%
in stock  
$1,741.00   $1,219.00
- +
100g
97%
in stock  
$6,118.00   $4,283.00
- +
  • Technical Information
  • Properties
  • Downstream Synthesis Route
  • Literature
  • Request for Quotation
  • Download SDS
Technical Information
Catalog Number:
AA0025GL
Chemical Name:
Benzoyl chloride, 3,4,5-trifluoro-
CAS Number:
177787-26-7
Molecular Formula:
C7H2ClF3O
Molecular Weight:
194.5384
MDL Number:
MFCD00083526
SMILES:
ClC(=O)c1cc(F)c(c(c1)F)F
Properties
Properties
 
BP:
184.7°C at 760 mmHg  
Form:
Liquid  
MP:
122-123℃  
Refractive Index:
n20/D 1.4900(lit.)  
Stability:
Lachrymatory  
Storage:
Inert atmosphere;Room Temperature;  

Computed Properties
 
Complexity:
176  
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0  
Defined Bond Stereocenter Count:
0  
Formal Charge:
0  
Heavy Atom Count:
12  
Hydrogen Bond Acceptor Count:
4  
Hydrogen Bond Donor Count:
0  
Isotope Atom Count:
0  
Rotatable Bond Count:
1  
Undefined Atom Stereocenter Count:
0  
Undefined Bond Stereocenter Count:
0  
XLogP3:
2.7  

Downstream Synthesis Route
177787-26-7    501701-42-4   
<i>N</i>-1-(2,4-dimethoxy-benzyloxycarbamoyl)-2-hydroxy-ethyl-3,4,5-trifluoro-benzamide 

[1]Pirrung,MichaelC.;Tumey,L.Nathan;McClerren,AmandaL.;Raetz,ChristianR.H.[JournaloftheAmericanChemicalSociety,2003,vol.125,#6,p.1575-1586]

32677-01-3    177787-26-7   
di-tert-butyl3,4,5-trifluorobenzoyl-L-glutamate 

[1]Davies,LawrenceC.;Friedlos,Frank;Hedley,Douglas;Martin,Jan;Ogilvie,LesleyM.;Scanlon,IanJ.;Springer,CarolineJ.[JournalofMedicinalChemistry,2005,vol.48,#16,p.5321-5328]

[1]Davies,LawrenceC.;Friedlos,Frank;Hedley,Douglas;Martin,Jan;Ogilvie,LesleyM.;Scanlon,IanJ.;Springer,CarolineJ.[JournalofMedicinalChemistry,2005,vol.48,#16,p.5321-5328]

1018975-59-1    177787-26-7   
2-propyl-4-(trifluoromethyl)-1-5-(3,4,5-trifluorophenyl)-1,2,4-oxadiazol-3-ylmethyl}-1H-indole-5-carbonitrile 

[1]CurrentPatentAssignee:GLAXOSMITHKLINEPLC-WO2008/42571,2008,A2Locationinpatent:Page/Pagecolumn259-260

C7H4BrF3Zn 
  177787-26-7   
C14H6F6O 

[1]Gore,VijayK.;Ma,VuV.;Tamir,Rami;Gavva,NarenderR.;Treanor,JamesJ.S.;Norman,MarkH.[BioorganicandMedicinalChemistryLetters,2007,vol.17,#21,p.5825-5830]

Literature
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Additional Info:
SDS
Tags:177787-26-7 Molecular Formula|177787-26-7 MDL|177787-26-7 SMILES|177787-26-7 Benzoyl chloride, 3,4,5-trifluoro-
Catalog No.: AA0025GL
177787-26-7,MFCD00083526
177787-26-7 | Benzoyl chloride, 3,4,5-trifluoro-
Pack Size: 250mg
Purity: 97%
in stock
$86.00 $60.00
Pack Size: 1g
Purity: 97%
in stock
$141.00 $99.00
Pack Size: 5g
Purity: 97%
in stock
$432.00 $303.00
Pack Size: 25g
Purity: 97%
in stock
$1,741.00 $1,219.00
Pack Size: 100g
Purity: 97%
in stock
$6,118.00 $4,283.00
Quantity
- +
Add to Card
Order Now
bulk Quotation Request
Technical Information
Catalog Number: AA0025GL
Chemical Name: Benzoyl chloride, 3,4,5-trifluoro-
CAS Number: 177787-26-7
Molecular Formula: C7H2ClF3O
Molecular Weight: 194.5384
MDL Number: MFCD00083526
SMILES: ClC(=O)c1cc(F)c(c(c1)F)F
Properties
BP: 184.7°C at 760 mmHg  
Form: Liquid  
MP: 122-123℃  
Refractive Index: n20/D 1.4900(lit.)  
Stability: Lachrymatory  
Storage: Inert atmosphere;Room Temperature;  
Complexity: 176  
Covalently-Bonded Unit Count: 1  
Defined Atom Stereocenter Count: 0  
Defined Bond Stereocenter Count: 0  
Formal Charge: 0  
Heavy Atom Count: 12  
Hydrogen Bond Acceptor Count: 4  
Hydrogen Bond Donor Count: 0  
Isotope Atom Count: 0  
Rotatable Bond Count: 1  
Undefined Atom Stereocenter Count: 0  
Undefined Bond Stereocenter Count: 0  
XLogP3: 2.7  
Downstream Synthesis Route
177787-26-7    501701-42-4   
<i>N</i>-1-(2,4-dimethoxy-benzyloxycarbamoyl)-2-hydroxy-ethyl-3,4,5-trifluoro-benzamide 

[1]Pirrung,MichaelC.;Tumey,L.Nathan;McClerren,AmandaL.;Raetz,ChristianR.H.[JournaloftheAmericanChemicalSociety,2003,vol.125,#6,p.1575-1586]

32677-01-3    177787-26-7   
di-tert-butyl3,4,5-trifluorobenzoyl-L-glutamate 

[1]Davies,LawrenceC.;Friedlos,Frank;Hedley,Douglas;Martin,Jan;Ogilvie,LesleyM.;Scanlon,IanJ.;Springer,CarolineJ.[JournalofMedicinalChemistry,2005,vol.48,#16,p.5321-5328]

1907-33-1    177787-26-7    863562-09-8 

[1]Davies,LawrenceC.;Friedlos,Frank;Hedley,Douglas;Martin,Jan;Ogilvie,LesleyM.;Scanlon,IanJ.;Springer,CarolineJ.[JournalofMedicinalChemistry,2005,vol.48,#16,p.5321-5328]

1018975-59-1    177787-26-7   
2-propyl-4-(trifluoromethyl)-1-5-(3,4,5-trifluorophenyl)-1,2,4-oxadiazol-3-ylmethyl}-1H-indole-5-carbonitrile 

[1]CurrentPatentAssignee:GLAXOSMITHKLINEPLC-WO2008/42571,2008,A2Locationinpatent:Page/Pagecolumn259-260

C7H4BrF3Zn 
  177787-26-7   
C14H6F6O 

[1]Gore,VijayK.;Ma,VuV.;Tamir,Rami;Gavva,NarenderR.;Treanor,JamesJ.S.;Norman,MarkH.[BioorganicandMedicinalChemistryLetters,2007,vol.17,#21,p.5825-5830]

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