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119515-20-7

119515-20-7 | 1-Piperidinecarboxylic acid, 2-(2-hydroxyethyl)-, butyl ester

CAS No: 119515-20-7 Catalog No: AG000IX2 MDL No:

Product Description

Catalog Number:
AG000IX2
Chemical Name:
1-Piperidinecarboxylic acid, 2-(2-hydroxyethyl)-, butyl ester
CAS Number:
119515-20-7
Molecular Formula:
C12H23NO3
Molecular Weight:
229.3159
IUPAC Name:
butyl 2-(2-hydroxyethyl)piperidine-1-carboxylate
InChI:
InChI=1S/C12H23NO3/c1-2-3-10-16-12(15)13-8-5-4-6-11(13)7-9-14/h11,14H,2-10H2,1H3
InChI Key:
CDBLSZZSQWYMLK-UHFFFAOYSA-N
SMILES:
CCCCOC(=O)N1CCCCC1CCO

Properties

Complexity:
208  
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:
6  
Topological Polar Surface Area:
49.8A^2
Undefined Atom Stereocenter Count:
1  
Undefined Bond Stereocenter Count:
0
XLogP3:
2  

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