Lot numbers can be found on the outside label of a product:
Phenanthrene-9-carboxylic acid
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CAS No. 837-45-6
- Cat. No. CS-0155998
- Purity≥96%
- MDL No.MFCD00019111
*For research and further manufacturing use only, not for direct human use.
Structure of 837-45-6
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General Information
- CAS No. 837-45-6
- Cat. No. CS-0155998
- Purity ≥96%
- MDL No. MFCD00019111
- Storage Store at room temperature
- Shipping Room temperature in continental US; may vary elsewhere.
- Molecular Formula C₁₅H₁₀O₂
- Molecular Weight 222.24
- Synonym(s) 9-Phenanthrenecarboxylic acid
- SMILES C1=CC=C2C(=C1)C=C(C3=CC=CC=C23)C(=O)O
Description
Phenanthrene-9-carboxylic acid features a rigid polycyclic aromatic core with a carboxylic acid group at the 9-position, enabling direct functionalization in synthesis. This configuration supports integration into conjugated systems and facilitates derivatization for materials applications requiring extended π-delocalization and controlled polarity.
Application
Phenanthrene-9-carboxylic acid serves as a versatile building block in synthetic organic chemistry, enabling direct functionalization at the 9-position of the phenanthrene core. Its carboxylic acid group facilitates amide formation, esterification, and metal complexation, while the rigid polycyclic framework provides structural stability and defined spatial orientation. This compound functions effectively in ligand design, pharmaceutical intermediates, and materials science applications, offering predictable reactivity and ease of purification under standard bench conditions.
Synthesis
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Route1
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124-38-9 -
In-stock
85-01-8 - ~91%
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In-stock
837-45-6
References
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Nemoto, Koji; Yoshida, Hiroki; Egusa, Naoki; Morohashi, Naoya; Hattori, Tetsutaro Journal of Organic Chemistry, 2010 , vol. 75, # 22 p. 7855 - 7862
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Route2
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89346-67-8
- ~93%
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In-stock
837-45-6
References
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Wassmundt, Frederick W.; Kiesman, William F. Journal of Organic Chemistry, 1995 , vol. 60, # 1 p. 196 - 201
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Route3
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In-stock
2510-55-6 - ~88%
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In-stock
837-45-6
References
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Nikolaitchik, Alexander V.; Rodgers, Michael A. J.; Neckers, Douglas C. Journal of Organic Chemistry, 1996 , vol. 61, # 3 p. 1065 - 1072
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Safety Information
Download SDS|
GHS Pictogram :
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GHS No : GHS07
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Signal Word : Warning
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UN#: N/A
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Class : N/A
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Packing Group : N/A
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Hazard Statements : H302-H315-H319-H335
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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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Quality Control
Computational Chemistry Data
- TPSA 37.3
- LogP 3.6912
- H_Acceptors 1
- H_Donors 1
- Rotatable_Bonds 1
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Key Words
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