6-Amino-3,4-dihydroisoquinolin-1(2H)-one

Name: 6-Amino-3,4-dihydroisoquinolin-1(2H)-one
Brand: ChemScene
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CAS No. 22246-00-0
Cat. No. CS-0199518
Purity≥95%
MDL No.MFCD11007917

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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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6-Amino-3,4-dihydroisoquinolin-1(2H)-one|CS-0199518

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General Information

CAS No. 22246-00-0
Cat. No. CS-0199518
Purity ≥95%
MDL No. MFCD11007917
Storage 4°C, protect from light
Shipping Room temperature in continental US; may vary elsewhere.
Molecular Formula C₉H₁₀N₂O
Molecular Weight 162.19
Synonym(s) 6-Amino-3,4-dihydro-1(2H)-isoquinolinone
SMILES C1=C(C=C2CCNC(=O)C2=C1)N

Description

6-Amino-3,4-dihydroisoquinolin-1(2H)-one features a fused heterocyclic core with a primary amine at the C6 position and a lactam carbonyl at C1, enabling direct functionalization in synthetic routes. This scaffold exhibits enhanced solubility and stability under standard conditions, facilitating its use in medicinal chemistry and peptide conjugation workflows.

Application

6-Amino-3,4-dihydroisoquinolin-1(2H)-one serves as a versatile scaffold in medicinal chemistry, enabling direct access to biologically relevant isoquinoline derivatives. Its amino and carbonyl functionalities support diverse transformations, including reductive amination, amidation, and electrophilic substitution. The compound exhibits good bench stability and facilitates straightforward purification, making it well-suited for iterative synthesis campaigns and lead optimization workflows.

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 : H302-H315-H319-H335
Precautionary Statements : P261-P264-P270-P271-P280-P302+P352-P304+P340-P330-P362+P364-P405-P501

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Computational Chemistry Data

TPSA 55.12
LogP 0.5547
H_Acceptors 2
H_Donors 2
Rotatable_Bonds 0

Other Classifications

Building Blocks Skeleton Aromatic heterocycle compounds Tetrahydroisoquinoline compounds

Key Words

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6-Amino-3,4-dihydroisoquinolin-1(2H)-one

CAS No. 22246-00-0

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