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236406-33-0 | 1-Piperidinecarboxylic acid, 4-(2-hydroxyethyl)-4-methyl-, 1,1-dimethylethyl ester
CAS No: 236406-33-0 Catalog No: AG002NZL MDL No:MFCD22628147
Product Description
Catalog Number:
AG002NZL
Chemical Name:
1-Piperidinecarboxylic acid, 4-(2-hydroxyethyl)-4-methyl-, 1,1-dimethylethyl ester
CAS Number:
236406-33-0
Molecular Formula:
C13H25NO3
Molecular Weight:
243.3425
MDL Number:
MFCD22628147
IUPAC Name:
tert-butyl 4-(2-hydroxyethyl)-4-methylpiperidine-1-carboxylate
InChI:
InChI=1S/C13H25NO3/c1-12(2,3)17-11(16)14-8-5-13(4,6-9-14)7-10-15/h15H,5-10H2,1-4H3
InChI Key:
RXLUHODTRLEMKU-UHFFFAOYSA-N
SMILES:
OCCC1(C)CCN(CC1)C(=O)OC(C)(C)C
Properties
Complexity:
262
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
243.183g/mol
Formal Charge:
0
Heavy Atom Count:
17
Hydrogen Bond Acceptor Count:
3
Hydrogen Bond Donor Count:
1
Isotope Atom Count:
0
Molecular Weight:
243.347g/mol
Monoisotopic Mass:
243.183g/mol
Rotatable Bond Count:
4
Topological Polar Surface Area:
49.8A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
1.9
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