4,4,4-Trifluoro-3-(4-oxothieno[2,3-d]pyrimidin-3(4H)-yl)butanoic acid

Name: 4,4,4-Trifluoro-3-(4-oxothieno[2,3-d]pyrimidin-3(4H)-yl)butanoic acid
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CAS No. 1114823-92-5
Cat. No. CS-0484285
Molecule weight292.23
Purity≥98%
MDL No.MFCD11505539

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4,4,4-Trifluoro-3-(4-oxothieno[2,3-d]pyrimidin-3(4H)-yl)butanoic acid|CS-0484285

Structure of 1114823-92-5

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General Information

CAS No. 1114823-92-5
Cat. No. CS-0484285
Purity ≥98%
MDL No. MFCD11505539
Storage Sealed in dry,2-8℃
Shipping Room temperature in continental US; may vary elsewhere.
Molecular Formula C₁₀H₇F₃N₂O₃S
Molecular Weight 292.23
Synonym(s) 4,4,4-Trifluoro-3-{4-oxo-3H,4H-thieno[2,3-d]pyrimidin-3-yl}butanoic Acid
SMILES OC(=O)CC(N1C=NC2=C(C=CS2)C1=O)C(F)(F)F

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 72.19
LogP 2.0361
H_Acceptors 5
H_Donors 1
Rotatable_Bonds 3

Other Classifications

Building Blocks Functional Group Carboxylic Acid

Building Blocks Skeleton Aromatic heterocycle compounds Pyrimidine compounds

Building Blocks Skeleton Aromatic heterocycle compounds Thiophene compounds

Key Words

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4,4,4-Trifluoro-3-(4-oxothieno[2,3-d]pyrimidin-3(4H)-yl)butanoic acid

CAS No. 1114823-92-5

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