5-Bromo-2-(1h-pyrazol-1-yl)benzonitrile

Name: 5-Bromo-2-(1h-pyrazol-1-yl)benzonitrile
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CAS No. 742100-11-4
Cat. No. CS-0671152
Molecule weight248.08
Purity≥98%
MDL No.MFCD27990372

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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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5-Bromo-2-(1h-pyrazol-1-yl)benzonitrile|CS-0671152

Structure of 742100-11-4

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General Information

CAS No. 742100-11-4
Cat. No. CS-0671152
Purity ≥98%
MDL No. MFCD27990372
Storage Sealed in dry,2-8℃
Shipping Room temperature in continental US; may vary elsewhere.
Molecular Formula C₁₀H₆BrN₃
Molecular Weight 248.08
Synonym(s) None
SMILES C1=CN(N=C1)C2=C(C=C(C=C2)Br)C#N

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 41.61
LogP 2.50648
H_Acceptors 3
H_Donors 0
Rotatable_Bonds 1

Other Classifications

Building Blocks Functional Group Bromide

Building Blocks Skeleton Aromatic heterocycle compounds Pyrazole compounds

Building Blocks Skeleton Aromatic ring compounds Benzene compounds

Key Words

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5-Bromo-2-(1h-pyrazol-1-yl)benzonitrile

CAS No. 742100-11-4

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