Home Amines 1492-26-8
1492-26-8,MFCD18642151
Catalog No.:AA001LDD

1492-26-8 | 1-Propanaminium, 3-carboxy-N,N,N-trimethyl-2-(1-oxobutoxy)-, inner salt

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  • Technical Information
  • Properties
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  • Technical Information
  • Properties
  • Literature
Technical Information
Catalog Number:
AA001LDD
Chemical Name:
1-Propanaminium, 3-carboxy-N,N,N-trimethyl-2-(1-oxobutoxy)-, inner salt
CAS Number:
1492-26-8
Molecular Formula:
C11H21NO4
Molecular Weight:
231.2887
MDL Number:
MFCD18642151
SMILES:
CCCC(=O)OC(C[N+](C)(C)C)CC(=O)[O-]
Properties
Computed Properties
 
Complexity:
239  
Covalently-Bonded Unit Count:
1  
Heavy Atom Count:
16  
Hydrogen Bond Acceptor Count:
4  
Rotatable Bond Count:
7  
Undefined Atom Stereocenter Count:
1  
XLogP3:
1.2  

Literature

Title: Insights into myalgic encephalomyelitis/chronic fatigue syndrome phenotypes through comprehensive metabolomics.

Journal: Scientific reports 20180101

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SDS
Tags:1492-26-8 Molecular Formula|1492-26-8 MDL|1492-26-8 SMILES|1492-26-8 1-Propanaminium, 3-carboxy-N,N,N-trimethyl-2-(1-oxobutoxy)-, inner salt