2-Allyl-5-nitroisoquinolin-1(2H)-one

Name: 2-Allyl-5-nitroisoquinolin-1(2H)-one
Brand: ChemScene
Availability: OutOfStock
Rating: 5 (1 reviews)

CAS No. 400076-44-0
Cat. No. CS-0594511
Purity≥98%
MDL No.None

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Each bottle is packed as an Excepted Quantity, with a maximum of 1g for items in class 6.1 packing group I or II, and up to 25g for all other hazardous materials.

If shipping is charged to your FedEx account, the HazMat fee will be billed directly by the courier. Otherwise, the fee will be included on your invoice. To help you avoid the HazMat fee, we can package a 5g order of a class 6.1 packing group I or II material as five separate 1g units, and a 100g order of any other dangerous good as four 25g units. This packaging adjustment will be made unless you instruct otherwise on your purchase order. Below, you will find the fee schedule from FedEx for handling hazardous materials.

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.

There is a HazMat shipping fee for each item that qualifies as a dangerous good. Please contact our quotation team via email to confirm the details.

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

2-Allyl-5-nitroisoquinolin-1(2H)-one|CS-0594511

Structure of 400076-44-0

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General Information

CAS No. 400076-44-0
Cat. No. CS-0594511
Purity ≥98%
MDL No. None
Storage Sealed in dry,2-8℃
Shipping Room temperature in continental US; may vary elsewhere.
Molecular Formula C₁₂H₁₀N₂O₃
Molecular Weight 230.22
Synonym(s) None
SMILES C=CCN1C=CC2=C(C1=O)C=CC=C2[N+](=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

Quality Control

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Computational Chemistry Data

TPSA 65.14
LogP 2.0957
H_Acceptors 4
H_Donors 0
Rotatable_Bonds 3

Other Classifications

Building Blocks Functional Group Nitro compounds

Building Blocks Skeleton Aromatic heterocycle compounds Isoquinoline compounds

Building Blocks Skeleton Aromatic ring compounds Benzene compounds

Key Words

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2-Allyl-5-nitroisoquinolin-1(2H)-one

CAS No. 400076-44-0

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