N-(3-Nitrophenyl)-2,2,2-trifluoroacetamide

Name: N-(3-Nitrophenyl)-2,2,2-trifluoroacetamide
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CAS No. 25080-83-5
Cat. No. CS-0213497
Purity≥98%
MDL No.MFCD00452601

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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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N-(3-Nitrophenyl)-2,2,2-trifluoroacetamide|CS-0213497

Structure of 25080-83-5

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General Information

CAS No. 25080-83-5
Cat. No. CS-0213497
Purity ≥98%
MDL No. MFCD00452601
Storage Sealed in dry,2-8℃
Shipping Room temperature in continental US; may vary elsewhere.
Molecular Formula C₈H₅F₃N₂O₃
Molecular Weight 234.13
Synonym(s) 2,2,2-trifluoro-N-(3-nitrophenyl)acetamide
SMILES O=C(NC1=CC=CC([N+]([O-])=O)=C1)C(F)(F)F

Synthesis

Route1
- 99-09-2
- 407-25-0
- ~99%
- 25080-83-5
References
- Guo, Zhengmao; Xian, Ming; Zhang, Wei; McGill, Andrea; Wang, Peng George Bioorganic and Medicinal Chemistry, 2001 , vol. 9, # 1 p. 99 - 106
Route2
- 99-09-2
- 76-05-1
- ~96%
- 25080-83-5
References
- Ohtaka, Junpei; Sakamoto, Takeshi; Kikugawa, Yasuo Tetrahedron Letters, 2009 , vol. 50, # 15 p. 1681 - 1683

Safety Information

Download SDS

GHS Pictogram : N/A	GHS No : N/A
Signal Word : N/A	UN#: N/A
Class : N/A	Packing Group : N/A
Hazard Statements : N/A
Precautionary Statements : N/A

Quality Control

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Computational Chemistry Data

TPSA 72.24
LogP 2.0956
H_Acceptors 3
H_Donors 1
Rotatable_Bonds 2

Other Classifications

Building Blocks Functional Group Amide

Building Blocks Functional Group Nitro compounds

Building Blocks Skeleton Aromatic ring compounds Benzene compounds

Key Words

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N-(3-Nitrophenyl)-2,2,2-trifluoroacetamide

CAS No. 25080-83-5

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General Information

Synthesis

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