3-Chloro-4-methoxy-benzylamine

Name: 3-Chloro-4-methoxy-benzylamine
Brand: ChemScene
Availability: InStock
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CAS No. 115514-77-7
Cat. No. CS-0342887
Purity≥98%
MDL No.MFCD00995395

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3-Chloro-4-methoxy-benzylamine|CS-0342887

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General Information

CAS No. 115514-77-7
Cat. No. CS-0342887
Purity ≥98%
MDL No. MFCD00995395
Storage 4°C, protect from light
Shipping Room temperature in continental US; may vary elsewhere.
Molecular Formula C₈H₁₀ClNO
Molecular Weight 171.62
Synonym(s) Benzenemethanamine, 3-chloro-4-methoxy-
SMILES COC1=C(C=C(C=C1)CN)Cl

Description

3-Chloro-4-methoxy-benzylamine features a benzylamine scaffold substituted with electron-donating methoxy and electron-withdrawing chloro groups at the meta and para positions, respectively. This electronic asymmetry enhances its reactivity in nucleophilic coupling processes. The compound exhibits bench-stable handling characteristics and integrates readily into synthetic routes for bioactive molecule construction.

Application

3-Chloro-4-methoxy-benzylamine serves as a versatile building block in medicinal chemistry, enabling the synthesis of bioactive heterocycles and functionalized arylamines. Its ortho-chloro and para-methoxy substituents provide orthogonal reactivity for downstream coupling and derivatization. The amine functionality facilitates easy purification and conjugation, while the benzyl scaffold offers enhanced metabolic stability. This compound functions reliably in standard amide coupling, Suzuki-Miyaura, and electrophilic substitution protocols.

Synthesis

Route1
- 2393-23-9
- ~35%
- In-stock
  
  115514-77-7
References
- Charifson; Wyrick; Hoffman; Ademe Simmons; Bowen; McDougald; Mailman Journal of Medicinal Chemistry, 1988 , vol. 31, # 10 p. 1941 - 1946

Safety Information

Download SDS

GHS Pictogram :	GHS No : GHS05
Signal Word : Danger	UN#: 2735
Class : 8	Packing Group : Ⅲ
Hazard Statements : H314-H318
Precautionary Statements : P280-P302+P352

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Computational Chemistry Data

TPSA 35.25
LogP 1.8073
H_Acceptors 2
H_Donors 1
Rotatable_Bonds 2

Other Classifications

Building Blocks Functional Group Chloride

Building Blocks Skeleton Aromatic ring compounds Benzene compounds

Key Words

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3-Chloro-4-methoxy-benzylamine

CAS No. 115514-77-7

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