Isoquinolin-3-ylmethanol

Name: Isoquinolin-3-ylmethanol
Brand: ChemScene
Availability: InStock
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CAS No. 76884-34-9
Cat. No. CS-0019309
Purity≥96%
MDL No.MFCD01859798

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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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Structure of 76884-34-9

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Description

Isoquinolin-3-ylmethanol serves as a key scaffold in medicinal chemistry, featuring a rigid heteroaromatic core with a reactive benzylic alcohol. This moiety integrates readily into bioactive molecules due to its favorable electronic profile and compatibility with diverse functionalizations. The hydroxymethyl group enables straightforward derivatization, while the isoquinoline framework contributes π-stacking potential and metabolic stability.

Application

Isoquinolin-3-ylmethanol serves as a versatile building block in medicinal chemistry, enabling direct functionalization at the benzylic position. Its bench-stable nature and compatibility with standard oxidation, substitution, and coupling reactions facilitate efficient access to diverse isoquinoline derivatives. The molecule functions effectively in late-stage modifications and scaffold elaboration for pharmaceutical discovery.

General Information

CAS No. 76884-34-9
Cat. No. CS-0019309
Purity ≥96%
MDL No. MFCD01859798
Storage Store at room temperature
Shipping Room temperature in continental US; may vary elsewhere.
Molecular Formula C₁₀H₉NO
Molecular Weight None
Synonym(s) Isoquinolin-3-ylmethanol; 3-Isoquinolinylmethanol
SMILES OCC1=CC2=C(C=N1)C=CC=C2

Computational Chemistry Data

TPSA 33.12
LogP 1.7271
H_Acceptors 2
H_Donors 1
Rotatable_Bonds 1

Safety Information

Download SDS

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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Other Classifications

Building Blocks Skeleton Aromatic heterocycle compounds Isoquinoline compounds

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Isoquinolin-3-ylmethanol

CAS No. 76884-34-9

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