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79307-93-0,MFCD00242783
Catalog No.:AA0034EJ

79307-93-0 | 4-[(4-chlorophenyl)methyl]-2-(1-methylazepan-4-yl)-1,2-dihydrophthalazin-1-one hydrochloride

Pack Size
Purity
Availability
Price(USD)
Quantity
  
1g
98%
in stock  
$32.00   $22.00
- +
5g
98%
in stock  
$115.00   $81.00
- +
25g
96%
in stock  
$552.00   $387.00
- +
100g
96%
in stock  
$1,791.00   $1,254.00
- +
  • Technical Information
  • Properties
  • Downstream Synthesis Route
  • Literature
  • Request for Quotation
  • Download SDS
  • Technical Information
  • Properties
  • Downstream Synthesis Route
  • Literature
Technical Information
Catalog Number:
AA0034EJ
Chemical Name:
4-[(4-chlorophenyl)methyl]-2-(1-methylazepan-4-yl)-1,2-dihydrophthalazin-1-one hydrochloride
CAS Number:
79307-93-0
Molecular Formula:
C22H27Cl2N3O
Molecular Weight:
420.3753
MDL Number:
MFCD00242783
SMILES:
CN1CCCC(CC1)N1NC(Cc2ccc(cc2)Cl)c2c(C1=O)cccc2.Cl
NSC Number:
758971
Properties
Properties
 
BP:
533.9°C at 760 mmHg  
Form:
Solid  
MP:
225--2290C  
Solubility:
DMSO: >10mg/mL  
Storage:
Inert atmosphere;-20 ℃;  

Computed Properties
 
Complexity:
558  
Covalently-Bonded Unit Count:
2  
Heavy Atom Count:
28  
Hydrogen Bond Acceptor Count:
3  
Hydrogen Bond Donor Count:
1  
Rotatable Bond Count:
3  
Undefined Atom Stereocenter Count:
1  

Downstream Synthesis Route

[1]JournaloftheAmericanChemicalSociety,2016,vol.138,p.15482-15487

[1]JournaloftheAmericanChemicalSociety,2016,vol.138,p.15482-15487

79307-93-0   
7-oxo-azelastine 
 
2-oxo-azelastine 

[1]OrganicLetters,2017,vol.19,p.870-873

Literature
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SDS
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Tags:79307-93-0 Molecular Formula|79307-93-0 MDL|79307-93-0 SMILES|79307-93-0 4-[(4-chlorophenyl)methyl]-2-(1-methylazepan-4-yl)-1,2-dihydrophthalazin-1-one hydrochloride