3-((4-Chlorophenyl)amino)cyclohex-2-en-1-one

Name: 3-((4-Chlorophenyl)amino)cyclohex-2-en-1-one
Brand: ChemScene
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CAS No. 36646-75-0
Cat. No. CS-0320207
Purity≥97%
MDL No.None

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3-((4-Chlorophenyl)amino)cyclohex-2-en-1-one|CS-0320207

Structure of 36646-75-0

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General Information

CAS No. 36646-75-0
Cat. No. CS-0320207
Purity ≥97%
MDL No. None
Storage Sealed in dry,2-8℃
Shipping Room temperature in continental US; may vary elsewhere.
Molecular Formula C₁₂H₁₂ClNO
Molecular Weight 221.68
Synonym(s) 3-[(4-Chlorophenyl)amino]cyclohex-2-en-1-one
SMILES C1CC(=CC(=O)C1)NC2=CC=C(C=C2)Cl

Synthesis

Route1
- In-stock
  
  504-02-9
- 106-47-8
- ~99%
- 36646-75-0
References
- Kaupp, Gerd; Schmeyers, Jens; Boy, Juergen Advanced Synthesis and Catalysis, 2000 , vol. 342, # 3 p. 269 - 280
Route2
- 106-47-8
- In-stock
  
  765-87-7
- ~85%
- 36646-75-0
References
- Zhuo, Jin-Cong Magnetic Resonance in Chemistry, 1997 , vol. 35, # 5 p. 311 - 322

Safety Information

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GHS Pictogram : N/A	GHS No : N/A
Signal Word : N/A	UN#: N/A
Class : N/A	Packing Group : N/A
Hazard Statements : N/A
Precautionary Statements : N/A

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Computational Chemistry Data

TPSA 29.1
LogP 3.3888
H_Acceptors 2
H_Donors 1
Rotatable_Bonds 2

Other Classifications

Building Blocks Skeleton Aromatic ring compounds Benzene compounds

Building Blocks Skeleton Fatty ring compounds Cyclohexane compounds

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3-((4-Chlorophenyl)amino)cyclohex-2-en-1-one

CAS No. 36646-75-0

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General Information

Synthesis

References