Home Carboxys 1-(ethoxycarbonyl)piperidine-3-carboxylic acid

1-(ethoxycarbonyl)piperidine-3-carboxylic acid

CAS No.:
944280-75-5
Catalog Number:
AG00ITVP
Molecular Formula:
C9H15NO4
Molecular Weight:
201.2197
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Product Description
Catalog Number:
AG00ITVP
Chemical Name:
1-(ethoxycarbonyl)piperidine-3-carboxylic acid
CAS Number:
944280-75-5
Molecular Formula:
C9H15NO4
Molecular Weight:
201.2197
MDL Number:
MFCD09816343
IUPAC Name:
1-ethoxycarbonylpiperidine-3-carboxylic acid
InChI:
InChI=1S/C9H15NO4/c1-2-14-9(13)10-5-3-4-7(6-10)8(11)12/h7H,2-6H2,1H3,(H,11,12)
InChI Key:
ZIVDFWFNURSULS-UHFFFAOYSA-N
SMILES:
CCOC(=O)N1CCCC(C1)C(=O)O
Properties
Complexity:
229  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
201.1g/mol
Formal Charge:
0
Heavy Atom Count:
14  
Hydrogen Bond Acceptor Count:
4  
Hydrogen Bond Donor Count:
1  
Isotope Atom Count:
0
Molecular Weight:
201.222g/mol
Monoisotopic Mass:
201.1g/mol
Rotatable Bond Count:
3  
Topological Polar Surface Area:
66.8A^2
Undefined Atom Stereocenter Count:
1  
Undefined Bond Stereocenter Count:
0
XLogP3:
0.5  
Properties