1-(4-(4-Nitrophenyl)-1,4-diazepan-1-yl)ethan-1-one

Name: 1-(4-(4-Nitrophenyl)-1,4-diazepan-1-yl)ethan-1-one
Brand: ChemScene
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CAS No. 892491-96-2
Cat. No. CS-0330511
Molecule weight263.29
Purity95+%
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-(4-Nitrophenyl)-1,4-diazepan-1-yl)ethan-1-one|CS-0330511

Structure of 892491-96-2

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General Information

CAS No. 892491-96-2
Cat. No. CS-0330511
Purity 95+%
MDL No. None
Storage Sealed in dry,2-8℃
Shipping Room temperature in continental US; may vary elsewhere.
Molecular Formula C₁₃H₁₇N₃O₃
Molecular Weight 263.29
Synonym(s) 1-Acetyl-4-(4-nitrophenyl)-1,4-diazepane
SMILES CC(=O)N1CCCN(CC1)C2=CC=C(C=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

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Computational Chemistry Data

TPSA 66.69
LogP 1.6534
H_Acceptors 4
H_Donors 0
Rotatable_Bonds 2

Other Classifications

Building Blocks Functional Group Ketone

Building Blocks Functional Group Nitro compounds

Building Blocks Skeleton Aliphatic heterocycle compounds Other aliphatic heterocycles compounds

Building Blocks Skeleton Aromatic ring compounds Benzene compounds

Key Words

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1-(4-(4-Nitrophenyl)-1,4-diazepan-1-yl)ethan-1-one

CAS No. 892491-96-2

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