1-(4-Chlorobenzyl)-3-nitro-1H-pyrazole-5-carboxylic acid

Name: 1-(4-Chlorobenzyl)-3-nitro-1H-pyrazole-5-carboxylic acid
Brand: ChemScene
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CAS No. 402614-96-4
Cat. No. CS-0327432
Molecule weight281.65
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+
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-(4-Chlorobenzyl)-3-nitro-1H-pyrazole-5-carboxylic acid|CS-0327432

Structure of 402614-96-4

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General Information

CAS No. 402614-96-4
Cat. No. CS-0327432
Purity ≥98%
MDL No. None
Storage Sealed in dry,2-8℃
Shipping Room temperature in continental US; may vary elsewhere.
Molecular Formula C₁₁H₈ClN₃O₄
Molecular Weight 281.65
Synonym(s) None
SMILES C1=C(C=CC(=C1)Cl)CN2C(=CC(=N2)[N+](=O)[O-])C(=O)O

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 98.26
LogP 2.1912
H_Acceptors 5
H_Donors 1
Rotatable_Bonds 4

Other Classifications

Building Blocks Functional Group Carboxylic Acid

Building Blocks Functional Group Nitro compounds

Building Blocks Skeleton Aromatic heterocycle compounds Pyrazole compounds

Building Blocks Skeleton Aromatic ring compounds Benzene compounds

Key Words

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1-(4-Chlorobenzyl)-3-nitro-1H-pyrazole-5-carboxylic acid

CAS No. 402614-96-4

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