Home Other Heterocycles 1370705-39-7
1370705-39-7,MFCD27664953
Catalog No.:AA0012PX

1370705-39-7 | 3-(Hydroxymethyl)bicyclo[1.1.1]pentane-1-carbonitrile

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100mg
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250mg
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500mg
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1g
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  • Technical Information
  • Properties
  • Downstream Synthesis Route
  • Literature
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  • Technical Information
  • Properties
  • Downstream Synthesis Route
  • Literature
Technical Information
Catalog Number:
AA0012PX
Chemical Name:
3-(Hydroxymethyl)bicyclo[1.1.1]pentane-1-carbonitrile
CAS Number:
1370705-39-7
Molecular Formula:
C7H9NO
Molecular Weight:
123.1525
MDL Number:
MFCD27664953
SMILES:
OCC12CC(C1)(C2)C#N
Properties
Computed Properties
 
Complexity:
180  
Covalently-Bonded Unit Count:
1  
Heavy Atom Count:
9  
Hydrogen Bond Acceptor Count:
2  
Hydrogen Bond Donor Count:
1  
Rotatable Bond Count:
1  
XLogP3:
-0.2  

Downstream Synthesis Route

[1]JournalofMedicinalChemistry,2012,vol.55,p.3414-3424

[1]JournalofMedicinalChemistry,2012,vol.55,p.3414-3424

[1]JournalofMedicinalChemistry,2012,vol.55,p.3414-3424

1370705-39-7    103935-47-3   
C9H12BrNO 

[1]Patent:CN107200734,2017,A.Locationinpatent:Paragraph0159-0160;0167-0168

Literature
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SDS
Tags:1370705-39-7 Molecular Formula|1370705-39-7 MDL|1370705-39-7 SMILES|1370705-39-7 3-(Hydroxymethyl)bicyclo[1.1.1]pentane-1-carbonitrile