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178312-62-4,MFCD02683070
Catalog No.:AA0025UA

178312-62-4 | 1,4-oxazepane HCl

Pack Size
Purity
Availability
Price(USD)
Quantity
  
100mg
97%
in stock  
$12.00   $8.00
- +
250mg
97%
in stock  
$15.00   $10.00
- +
500mg
97%
in stock  
$20.00   $14.00
- +
1g
97%
in stock  
$30.00   $21.00
- +
  • Technical Information
  • Properties
  • Downstream Synthesis Route
  • Literature
  • Request for Quotation
  • Download SDS
Technical Information
Catalog Number:
AA0025UA
Chemical Name:
1,4-oxazepane HCl
CAS Number:
178312-62-4
Molecular Formula:
C5H12ClNO
Molecular Weight:
137.6079
MDL Number:
MFCD02683070
SMILES:
C1CNCCOC1.Cl
Properties
Properties
 
Form:
Solid  
MP:
156-154 °C  
Stability:
Hygroscopic  
Storage:
Inert atmosphere;Room Temperature;  

Computed Properties
 
Complexity:
47.3  
Covalently-Bonded Unit Count:
2  
Defined Atom Stereocenter Count:
0  
Defined Bond Stereocenter Count:
0  
Formal Charge:
0  
Heavy Atom Count:
8  
Hydrogen Bond Acceptor Count:
2  
Hydrogen Bond Donor Count:
2  
Isotope Atom Count:
0  
Rotatable Bond Count:
0  
Undefined Atom Stereocenter Count:
0  
Undefined Bond Stereocenter Count:
0  

Downstream Synthesis Route
homomorpholinehydrochloride 
  477312-85-9    701938-93-4 

[1]JournalofMedicinalChemistry,2004,vol.47,p.2887-2896

[1]CurrentPatentAssignee:PFIZERINC-WO2007/644,2007,A1Locationinpatent:Page/Pagecolumn16;18

[2]Locationinpatent:schemeortableKim,Ji-Young;Boyer,FrederickE.;Choy,AllisonL.;Huband,MichaelD.;Pagano,PaulJ.;VaraPrasad[BioorganicandMedicinalChemistryLetters,2009,vol.19,#2,p.550-553]

178312-62-4   
CASUnavailable 

[1]CurrentPatentAssignee:GLAXOSMITHKLINEPLC-WO2007/138033,2007,A1Locationinpatent:Page/Pagecolumn30-31

CASUnavailable 
  178312-62-4    850646-86-5 

[1]CurrentPatentAssignee:SANOFI-WO2005/40142,2005,A1Locationinpatent:Page/Pagecolumn47

[1]CurrentPatentAssignee:SANOFI-WO2005/40142,2005,A1Locationinpatent:Page/Pagecolumn48-49

Literature
Quotation Request
Company Name:
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Quantity Required:
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Additional Info:
Submit
SDS
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Tags:178312-62-4 Molecular Formula|178312-62-4 MDL|178312-62-4 SMILES|178312-62-4 1,4-oxazepane HCl
Catalog No.: AA0025UA
178312-62-4,MFCD02683070
178312-62-4 | 1,4-oxazepane HCl
Pack Size： 100mg
Purity： 97%
in stock
$12.00 $8.00
Pack Size： 250mg
Purity： 97%
in stock
$15.00 $10.00
Pack Size： 500mg
Purity： 97%
in stock
$20.00 $14.00
Pack Size： 1g
Purity： 97%
in stock
$30.00 $21.00
Quantity
- +
Add to Card
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Technical Information
Catalog Number: AA0025UA
Chemical Name: 1,4-oxazepane HCl
CAS Number: 178312-62-4
Molecular Formula: C5H12ClNO
Molecular Weight: 137.6079
MDL Number: MFCD02683070
SMILES: C1CNCCOC1.Cl
Properties
Form: Solid  
MP: 156-154 °C  
Stability: Hygroscopic  
Storage: Inert atmosphere;Room Temperature;  
Complexity: 47.3  
Covalently-Bonded Unit Count: 2  
Defined Atom Stereocenter Count: 0  
Defined Bond Stereocenter Count: 0  
Formal Charge: 0  
Heavy Atom Count: 8  
Hydrogen Bond Acceptor Count: 2  
Hydrogen Bond Donor Count: 2  
Isotope Atom Count: 0  
Rotatable Bond Count: 0  
Undefined Atom Stereocenter Count: 0  
Undefined Bond Stereocenter Count: 0  
Downstream Synthesis Route
homomorpholinehydrochloride 
  477312-85-9    701938-93-4 

[1]JournalofMedicinalChemistry,2004,vol.47,p.2887-2896

178312-62-4    350-46-9    471937-94-7 

[1]CurrentPatentAssignee:PFIZERINC-WO2007/644,2007,A1Locationinpatent:Page/Pagecolumn16;18

[2]Locationinpatent:schemeortableKim,Ji-Young;Boyer,FrederickE.;Choy,AllisonL.;Huband,MichaelD.;Pagano,PaulJ.;VaraPrasad[BioorganicandMedicinalChemistryLetters,2009,vol.19,#2,p.550-553]

178312-62-4   
CASUnavailable 

[1]CurrentPatentAssignee:GLAXOSMITHKLINEPLC-WO2007/138033,2007,A1Locationinpatent:Page/Pagecolumn30-31

CASUnavailable 
  178312-62-4    850646-86-5 

[1]CurrentPatentAssignee:SANOFI-WO2005/40142,2005,A1Locationinpatent:Page/Pagecolumn47

850646-61-6    178312-62-4    850646-88-7 

[1]CurrentPatentAssignee:SANOFI-WO2005/40142,2005,A1Locationinpatent:Page/Pagecolumn48-49

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