1-Isopropyl-3-(methoxycarbonyl)-1H-pyrazole-5-carboxylic acid

Name: 1-Isopropyl-3-(methoxycarbonyl)-1H-pyrazole-5-carboxylic acid
Brand: ChemScene
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CAS No. 617709-78-1
Cat. No. CS-0906470
Molecule weight212.20
Purity≥98%
MDL No.None

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Type	HazMat Fee
Excepted Quantity	$0.00
FedEx Limited Quantities Ground	$0.00
Hazmat Ground shipping	$50.00+
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Accessible (Haz class 3, 4, 5 or 8), Domestic	$158.00+
Inaccessible (Haz class 6.1 or 9), International	$108.00+
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1-Isopropyl-3-(methoxycarbonyl)-1H-pyrazole-5-carboxylic acid|CS-0906470

Structure of 617709-78-1

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General Information

CAS No. 617709-78-1
Cat. No. CS-0906470
Purity ≥98%
MDL No. None
Storage Sealed in dry,2-8℃
Shipping Room temperature in continental US; may vary elsewhere.
Molecular Formula C₉H₁₂N₂O₄
Molecular Weight 212.20
Synonym(s) None
SMILES O=C(C1=NN(C(C)C)C(C(O)=O)=C1)OC

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 81.42
LogP 0.9488
H_Acceptors 5
H_Donors 1
Rotatable_Bonds 3

Other Classifications

Building Blocks Functional Group Ester

Building Blocks Skeleton Aromatic heterocycle compounds Pyrazole compounds

Key Words

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1-Isopropyl-3-(methoxycarbonyl)-1H-pyrazole-5-carboxylic acid

CAS No. 617709-78-1

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