Methyl 7-hydroxy-2-naphthoate

Name: Methyl 7-hydroxy-2-naphthoate
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CAS No. 95901-05-6
Cat. No. CS-0040103
Purity≥98%
MDL No.MFCD11226994

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Methyl 7-hydroxy-2-naphthoate|CS-0040103

Structure of 95901-05-6

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General Information

CAS No. 95901-05-6
Cat. No. CS-0040103
Purity ≥98%
MDL No. MFCD11226994
Storage RT, stored under nitrogen
Shipping Room temperature in continental US; may vary elsewhere.
Molecular Formula C₁₂H₁₀O₃
Molecular Weight 202.21
Synonym(s) Methyl 7-hydroxynaphthalene-2-carboxylate
SMILES O=C(C1=CC=C2C=CC(O)=CC2=C1)OC

Description

Methyl 7-hydroxy-2-naphthoate features a hydroxyl group at the 7-position of the naphthalene core, enhancing solubility and reactivity in synthetic transformations. This electron-rich scaffold facilitates coupling reactions and serves as a key intermediate in the development of functionalized naphthoic acid derivatives for pharmaceutical and materials applications.

Application

Methyl 7-hydroxy-2-naphthoate serves as a versatile building block in the synthesis of naphthoic acid derivatives and functionalized heterocycles. The phenolic hydroxyl group enables direct derivatization via esterification, etherification, or metal-catalyzed coupling, while the methyl ester provides a handle for selective reduction or hydrolysis. Its stability under standard bench conditions and compatibility with common protecting group strategies facilitate efficient access to complex scaffolds in medicinal chemistry and materials science applications.

Synthesis

Route1
- 67-56-1
- 201230-82-2
- 151391-01-4
- ~%
- In-stock
  
  95901-05-6
References
- ELI LILLY AND COMPANY Patent: WO2006/69153 A2, 2006 ; Location in patent: Page/Page column 34 ; WO 2006/069153 A2
Route2
- 5088-92-6
- ~%
- In-stock
  
  95901-05-6
References
- Gueller, Rolf; Binggeli, Alfred; Breu, Volker; Bur, Daniel; Fischli, Walter; Hirth, Georges; Jenny, Christian; Kansy, Manfred; Montavon, Francois; Mueller, Marcel; Oefner, Christian; Stadler, Heinz; Vieira, Eric; Wilhelm, Maurice; Wostl, Wolfgang; Maerki, Hans Peter Bioorganic and Medicinal Chemistry Letters, 1999 , vol. 9, # 10 p. 1403 - 1408

Safety Information

Download SDS

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-P305+P351+P338-P330-P362+P364-P403+P233-P405-P501

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Computational Chemistry Data

TPSA 46.53
LogP 2.332
H_Acceptors 3
H_Donors 1
Rotatable_Bonds 1

Other Classifications

Building Blocks Functional Group Ester

Building Blocks Skeleton Aromatic ring compounds Naphthalene compounds

Key Words

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Methyl 7-hydroxy-2-naphthoate

CAS No. 95901-05-6

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