1-(3,5-Bis(trifluoromethyl)phenyl)propan-1-one

Name: 1-(3,5-Bis(trifluoromethyl)phenyl)propan-1-one
Brand: ChemScene
Availability: InStock
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CAS No. 85068-34-4
Cat. No. CS-0152657
Purity≥98%
MDL No.MFCD00009911

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Type	HazMat Fee
Excepted Quantity	$0.00
FedEx Limited Quantities Ground	$0.00
Hazmat Ground shipping	$50.00+
Inaccessible (Haz class 6.1 or 9), Domestic	$68.00+
Accessible (Haz class 3, 4, 5 or 8), Domestic	$158.00+
Inaccessible (Haz class 6.1 or 9), International	$108.00+
Accessible (Haz class 3, 4, 5 or 8), International	$238.00+

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1-(3,5-Bis(trifluoromethyl)phenyl)propan-1-one|CS-0152657

Structure of 85068-34-4

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General Information

CAS No. 85068-34-4
Cat. No. CS-0152657
Purity ≥98%
MDL No. MFCD00009911
Storage Store at room temperature
Shipping Room temperature in continental US; may vary elsewhere.
Molecular Formula C₁₁H₈F₆O
Molecular Weight None
Synonym(s) 3',5'-Bis(trifluoromethyl)propiophenone
SMILES CCC(=O)C1=CC(=CC(=C1)C(F)(F)F)C(F)(F)F

Synthesis

Route1
- 184888-50-4
- ~%
- In-stock
  
  85068-34-4
References
- Bioorganic and Medicinal Chemistry Letters, , vol. 14, # 13 p. 3401 - 3406
Route2
- In-stock
  
  401-95-6
- ~%
- In-stock
  
  85068-34-4
References
- Bioorganic and Medicinal Chemistry Letters, , vol. 14, # 13 p. 3401 - 3406

Safety Information

Download SDS

GHS Pictogram :	GHS No : GHS07
Signal Word : Warning	UN#: N/A
Class : N/A	Packing Group : N/A
Hazard Statements : H227-H315-H319-H335
Precautionary Statements : P210-P261-P264-P271-P280-P302+P352-P304+P340-P362+P364-P370+P378-P403-P405-P501

Quality Control

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Computational Chemistry Data

TPSA 17.07
LogP 4.3169
H_Acceptors 1
H_Donors 0
Rotatable_Bonds 2

Other Classifications

Building Blocks Functional Group Ketone

Building Blocks Skeleton Aromatic ring compounds Benzene compounds

Key Words

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1-(3,5-Bis(trifluoromethyl)phenyl)propan-1-one

CAS No. 85068-34-4

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General Information

Synthesis

References