Lot numbers can be found on the outside label of a product:
N1-Phenylbenzene-1,2-diamine
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CAS No. 534-85-0
- Cat. No. CS-W015994
- Purity≥97%
- MDL No.MFCD00007685
*For research and further manufacturing use only, not for direct human use.
Structure of 534-85-0
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General Information
- CAS No. 534-85-0
- Cat. No. CS-W015994
- Purity ≥97%
- MDL No. MFCD00007685
- Storage 4°C, protect from light
- Shipping Room temperature in continental US; may vary elsewhere.
- Molecular Formula C₁₂H₁₂N₂
- Molecular Weight 184.24
- Synonym(s) N-Phenyl-o-phenylenediamine
- SMILES NC1=CC=CC=C1NC2=CC=CC=C2
Description
N1-Phenylbenzene-1,2-diamine features a dual amine architecture with an aryl-substituted nitrogen, enabling robust coordination in transition metal complexes. This configuration supports efficient ligand integration in catalytic systems and facilitates structural rigidity in functional materials.
Application
N1-Phenylbenzene-1,2-diamine serves as a versatile building block in heterocyclic synthesis, enabling efficient access to fused polycyclic systems via cyclization reactions. Its ortho-diamine motif facilitates metal-catalyzed coupling processes and oxidation-driven annulations, while the N-phenyl substituent enhances stability and modulates electronic properties. The compound exhibits good bench stability and is readily purified by standard chromatographic methods, making it well-suited for iterative synthetic workflows in medicinal chemistry and materials science applications.
Synthesis
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Route1
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In-stock
119-75-5 - ~98%
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In-stock
534-85-0
References
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Chuckowree, Irina; Ali Syed, Murtaza; Getti, Giulia; Parbhu Patel, Asha; Garner, Hannah; Tizzard, Graham J.; Coles, Simon J.; Spencer, John Tetrahedron Letters, 2012 , vol. 53, # 28 p. 3607 - 3611
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Route2
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100-65-2 -
74497-02-2
- ~%
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101-54-2
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In-stock
534-85-0
References
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WO2004/72028 A2, ; Page 12-15 ;
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Route3
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In-stock
591-50-4 -
95-54-5
- ~46%
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In-stock
534-85-0
References
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Gupta, Amit Kumar; Tirumaleswara Rao; Singh, Krishna Nand Tetrahedron Letters, 2012 , vol. 53, # 17 p. 2218 - 2221
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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+H332-H315
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Precautionary Statements : P261-P264-P270-P271-P280-P302+P352-P304+P340-P330-P362+P364-P501
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Quality Control
Computational Chemistry Data
- TPSA 38.05
- LogP 3.0124
- H_Acceptors 2
- H_Donors 2
- Rotatable_Bonds 2
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Key Words
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