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1419101-09-9 | 1-Piperidinecarboxylic acid, 4-(ethoxymethyl)-4-hydroxy-, 1,1-dimethylethyl ester
CAS No: 1419101-09-9 Catalog No: AG001HD2 MDL No:MFCD23106417
Product Description
Catalog Number:
AG001HD2
Chemical Name:
1-Piperidinecarboxylic acid, 4-(ethoxymethyl)-4-hydroxy-, 1,1-dimethylethyl ester
CAS Number:
1419101-09-9
Molecular Formula:
C13H25NO4
Molecular Weight:
259.3419
MDL Number:
MFCD23106417
IUPAC Name:
tert-butyl 4-(ethoxymethyl)-4-hydroxypiperidine-1-carboxylate
InChI:
InChI=1S/C13H25NO4/c1-5-17-10-13(16)6-8-14(9-7-13)11(15)18-12(2,3)4/h16H,5-10H2,1-4H3
InChI Key:
RXPJSQJGAHDOPU-UHFFFAOYSA-N
SMILES:
CCOCC1(O)CCN(CC1)C(=O)OC(C)(C)C
Properties
Complexity:
277
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
259.178g/mol
Formal Charge:
0
Heavy Atom Count:
18
Hydrogen Bond Acceptor Count:
4
Hydrogen Bond Donor Count:
1
Isotope Atom Count:
0
Molecular Weight:
259.346g/mol
Monoisotopic Mass:
259.178g/mol
Rotatable Bond Count:
5
Topological Polar Surface Area:
59A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
1
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