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124805-93-2 | 4-Piperidinecarboxylic acid, 1-methyl-, cyclohexylmethyl ester
CAS No: 124805-93-2 Catalog No: AG000MRS MDL No:
Product Description
Catalog Number:
AG000MRS
Chemical Name:
4-Piperidinecarboxylic acid, 1-methyl-, cyclohexylmethyl ester
CAS Number:
124805-93-2
Molecular Formula:
C14H25NO2
Molecular Weight:
239.3538
IUPAC Name:
cyclohexylmethyl 1-methylpiperidine-4-carboxylate
InChI:
InChI=1S/C14H25NO2/c1-15-9-7-13(8-10-15)14(16)17-11-12-5-3-2-4-6-12/h12-13H,2-11H2,1H3
InChI Key:
TZGNGTHMPGBSQW-UHFFFAOYSA-N
SMILES:
CN1CCC(CC1)C(=O)OCC1CCCCC1
Properties
Complexity:
241
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
239.189g/mol
Formal Charge:
0
Heavy Atom Count:
17
Hydrogen Bond Acceptor Count:
3
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
239.359g/mol
Monoisotopic Mass:
239.189g/mol
Rotatable Bond Count:
4
Topological Polar Surface Area:
29.5A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
3
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