Home Carboxys 1-(2-methylbutanoyl)piperidine-3-carboxylic acid

1-(2-methylbutanoyl)piperidine-3-carboxylic acid

CAS No.:
954584-11-3
Catalog Number:
AG01A90K
Molecular Formula:
C11H19NO3
Molecular Weight:
213.2735
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Product Description
Catalog Number:
AG01A90K
Chemical Name:
1-(2-methylbutanoyl)piperidine-3-carboxylic acid
CAS Number:
954584-11-3
Molecular Formula:
C11H19NO3
Molecular Weight:
213.2735
MDL Number:
MFCD09741809
IUPAC Name:
1-(2-methylbutanoyl)piperidine-3-carboxylic acid
InChI:
InChI=1S/C11H19NO3/c1-3-8(2)10(13)12-6-4-5-9(7-12)11(14)15/h8-9H,3-7H2,1-2H3,(H,14,15)
InChI Key:
BGYPWZQLAHUGGX-UHFFFAOYSA-N
SMILES:
CCC(C(=O)N1CCCC(C1)C(=O)O)C
Properties
Complexity:
252  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
213.136g/mol
Formal Charge:
0
Heavy Atom Count:
15  
Hydrogen Bond Acceptor Count:
3  
Hydrogen Bond Donor Count:
1  
Isotope Atom Count:
0
Molecular Weight:
213.277g/mol
Monoisotopic Mass:
213.136g/mol
Rotatable Bond Count:
3  
Topological Polar Surface Area:
57.6A^2
Undefined Atom Stereocenter Count:
2  
Undefined Bond Stereocenter Count:
0
XLogP3:
1.1  
Properties