Home Carboxys 1-isobutyrylpiperidine-3-carboxylic acid

1-isobutyrylpiperidine-3-carboxylic acid

CAS No.:
926214-33-7
Catalog Number:
AG00J9AB
Molecular Formula:
C10H17NO3
Molecular Weight:
199.2469
Pack Size
Purity
Availability
Location
Price(USD)
Quantity
  
Product Description
Catalog Number:
AG00J9AB
Chemical Name:
1-isobutyrylpiperidine-3-carboxylic acid
CAS Number:
926214-33-7
Molecular Formula:
C10H17NO3
Molecular Weight:
199.2469
MDL Number:
MFCD09050645
IUPAC Name:
1-(2-methylpropanoyl)piperidine-3-carboxylic acid
InChI:
InChI=1S/C10H17NO3/c1-7(2)9(12)11-5-3-4-8(6-11)10(13)14/h7-8H,3-6H2,1-2H3,(H,13,14)
InChI Key:
AQQXGLGQEUMZDG-UHFFFAOYSA-N
SMILES:
OC(=O)C1CCCN(C1)C(=O)C(C)C
Properties
Complexity:
238  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
199.121g/mol
Formal Charge:
0
Heavy Atom Count:
14  
Hydrogen Bond Acceptor Count:
3  
Hydrogen Bond Donor Count:
1  
Isotope Atom Count:
0
Molecular Weight:
199.25g/mol
Monoisotopic Mass:
199.121g/mol
Rotatable Bond Count:
2  
Topological Polar Surface Area:
57.6A^2
Undefined Atom Stereocenter Count:
1  
Undefined Bond Stereocenter Count:
0
XLogP3:
0.8  
Properties