Hexahydro-1,8(2H,5H)-naphthalenedione

Name: Hexahydro-1,8(2H,5H)-naphthalenedione
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CAS No. 83406-40-0
Cat. No. CS-0697814
Molecule weight166.22
Purity≥98%
MDL No.MFCD24689133

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Type	HazMat Fee
Excepted Quantity	$0.00
FedEx Limited Quantities Ground	$0.00
Hazmat Ground shipping	$50.00+
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Accessible (Haz class 3, 4, 5 or 8), Domestic	$158.00+
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Accessible (Haz class 3, 4, 5 or 8), International	$238.00+

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Hexahydro-1,8(2H,5H)-naphthalenedione|CS-0697814

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General Information

CAS No. 83406-40-0
Cat. No. CS-0697814
Purity ≥98%
MDL No. MFCD24689133
Storage -20°C, stored under nitrogen
Shipping Room temperature in continental US; may vary elsewhere.
Molecular Formula C₁₀H₁₄O₂
Molecular Weight 166.22
Synonym(s) None
SMILES O=C1CCCC2CCCC(C12)=O

Description

Hexahydro-1,8(2H,5H)-naphthalenedione features a saturated naphthalene core with strategically positioned ketone groups, enabling its use as a stable, electron-deficient scaffold in synthetic transformations. This rigid, bench-stable structure integrates readily into complex molecular architectures requiring controlled reactivity and defined spatial orientation.

Application

Hexahydro-1,8(2H,5H)-naphthalenedione serves as a versatile scaffold for heterocyclic synthesis, enabling efficient access to substituted tetralin and naphthalene derivatives. Its stable, fully saturated diketone core exhibits excellent functional group tolerance and facilitates robust transformations under standard conditions, including reductive amination and nucleophilic addition. The compound functions reliably in multi-step sequences and is well-suited for bench-scale applications requiring predictable reactivity and straightforward purification.

Safety Information

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GHS Pictogram :	GHS No : GHS07
Signal Word : Warning	UN#: N/A
Class : N/A	Packing Group : N/A
Hazard Statements : H315-H319-H335
Precautionary Statements : P260-P264-P271-P280-P302+P352-P304+P340-P305+P351+P338-P312-P332+P313-P337+P313-P362+P364-P403+P233-P405-P501

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Computational Chemistry Data

TPSA 37.3
LogP 2.3516
H_Acceptors 2
H_Donors 1
Rotatable_Bonds 0

Other Classifications

Building Blocks Functional Group Ketone

Building Blocks Skeleton Bridge Rings compounds Other bridge ring compounds

Key Words

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Hexahydro-1,8(2H,5H)-naphthalenedione

CAS No. 83406-40-0

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