2-(2,6-difluoro-3-nitrophenyl)acetic Acid

CAS No. 361336-78-9
Cat. No. CS-W000528
Molecule weight217.13
Purity≥95%
MDL No.MFCD08236851

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2-(2,6-difluoro-3-nitrophenyl)acetic Acid|CS-W000528

Structure of 361336-78-9

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General Information

CAS No. 361336-78-9
Cat. No. CS-W000528
Purity ≥95%
MDL No. MFCD08236851
Storage Sealed in dry,2-8℃
Shipping Room temperature in continental US; may vary elsewhere.
Molecular Formula C₈H₅F₂NO₄
Molecular Weight 217.13
Synonym(s) (2,6-Difluoro-3-nitro-phenyl)-acetic acid
SMILES OC(=O)Cc1c(F)ccc(c1F)[N+]([O-])=O

Synthesis

Route1
- In-stock
  
  85068-28-6
- ~89%
- 361336-78-9
References
- Parlow, John J.; Stevens, Anna M.; Stegeman, Roderick A.; Stallings, William C.; Kurumbail, Ravi G.; South, Michael S. Journal of Medicinal Chemistry, 2003 , vol. 46, # 20 p. 4297 - 4312

Safety Information

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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

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Computational Chemistry Data

TPSA 80.44
LogP 1.5001
H_Acceptors 3
H_Donors 1
Rotatable_Bonds 3

Other Classifications

Building Blocks Functional Group Carboxylic Acid

Building Blocks Functional Group Nitro compounds

Building Blocks Skeleton Aromatic ring compounds Benzene compounds

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2-(2,6-difluoro-3-nitrophenyl)acetic Acid

CAS No. 361336-78-9

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