2-(4-Ethynylphenyl)-2-methylpropanenitrile

Name: 2-(4-Ethynylphenyl)-2-methylpropanenitrile
Brand: ChemScene
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CAS No. 1314647-58-9
Cat. No. CS-0609845
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+

An item is classified as a dangerous good if our website displays Hazardous Material (HazMat) information for it.

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*For research and further manufacturing use only, not for direct human use.

2-(4-Ethynylphenyl)-2-methylpropanenitrile|CS-0609845

Structure of 1314647-58-9

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General Information

CAS No. 1314647-58-9
Cat. No. CS-0609845
Purity ≥98%
MDL No. None
Storage Sealed in dry,2-8℃
Shipping Room temperature in continental US; may vary elsewhere.
Molecular Formula C₁₂H₁₁N
Molecular Weight 169.22
Synonym(s) None
SMILES C#CC(C=C1)=CC=C1C(C)(C#N)C

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 23.79
LogP 2.46908
H_Acceptors 1
H_Donors 0
Rotatable_Bonds 1

Other Classifications

Building Blocks Functional Group Cyanide/Nitrile

Building Blocks Functional Group Alkyne

Building Blocks Skeleton Aromatic ring compounds Benzene compounds

Chemical Biology Pharmaceutical Development and Drug Discovery Research Conjugation Chemistry/Click Chemistry Terminal Alkynes

Chemical Biology Conjugation Chemistry/Click Chemistry Terminal Alkynes

Key Words

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2-(4-Ethynylphenyl)-2-methylpropanenitrile

CAS No. 1314647-58-9

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