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119515-25-2

119515-25-2 | 1-Piperidinecarboxylic acid, 2-(2-hydroxyethyl)-, 2-methylpropyl ester

CAS No: 119515-25-2 Catalog No: AG000IX1 MDL No:

Product Description

Catalog Number:
AG000IX1
Chemical Name:
1-Piperidinecarboxylic acid, 2-(2-hydroxyethyl)-, 2-methylpropyl ester
CAS Number:
119515-25-2
Molecular Formula:
C12H23NO3
Molecular Weight:
229.3159
IUPAC Name:
2-methylpropyl 2-(2-hydroxyethyl)piperidine-1-carboxylate
InChI:
InChI=1S/C12H23NO3/c1-10(2)9-16-12(15)13-7-4-3-5-11(13)6-8-14/h10-11,14H,3-9H2,1-2H3
InChI Key:
GAJBLKYYDVECGZ-UHFFFAOYSA-N
SMILES:
OCCC1CCCCN1C(=O)OCC(C)C

Properties

Complexity:
218  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
229.168g/mol
Formal Charge:
0
Heavy Atom Count:
16  
Hydrogen Bond Acceptor Count:
3  
Hydrogen Bond Donor Count:
1  
Isotope Atom Count:
0
Molecular Weight:
229.32g/mol
Monoisotopic Mass:
229.168g/mol
Rotatable Bond Count:
5  
Topological Polar Surface Area:
49.8A^2
Undefined Atom Stereocenter Count:
1  
Undefined Bond Stereocenter Count:
0
XLogP3:
2  

Literature

Title Journal
Mixture for controlling insecticide-resistant malaria vectors. Emerging infectious diseases 20081101
Efficacy of repellent products against caged and free flying Anopheles stephensi mosquitoes. The Southeast Asian journal of tropical medicine and public health 20051101

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