Home Carboxys 1-Piperidinecarboxylic acid, 4-[4-(ethoxycarbonyl)phenoxy]-, 1,1-dimethylethyl ester

1-Piperidinecarboxylic acid, 4-[4-(ethoxycarbonyl)phenoxy]-, 1,1-dimethylethyl ester

CAS No.:
210962-44-0
Catalog Number:
AG002L2V
Molecular Formula:
C19H27NO5
Molecular Weight:
349.4214
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Product Description
Catalog Number:
AG002L2V
Chemical Name:
1-Piperidinecarboxylic acid, 4-[4-(ethoxycarbonyl)phenoxy]-, 1,1-dimethylethyl ester
CAS Number:
210962-44-0
Molecular Formula:
C19H27NO5
Molecular Weight:
349.4214
MDL Number:
MFCD13184258
IUPAC Name:
tert-butyl 4-(4-ethoxycarbonylphenoxy)piperidine-1-carboxylate
InChI:
InChI=1S/C19H27NO5/c1-5-23-17(21)14-6-8-15(9-7-14)24-16-10-12-20(13-11-16)18(22)25-19(2,3)4/h6-9,16H,5,10-13H2,1-4H3
InChI Key:
RQAFJRAGEIMIBQ-UHFFFAOYSA-N
SMILES:
CCOC(=O)c1ccc(cc1)OC1CCN(CC1)C(=O)OC(C)(C)C
Properties
Complexity:
443  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
349.189g/mol
Formal Charge:
0
Heavy Atom Count:
25  
Hydrogen Bond Acceptor Count:
5  
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
349.427g/mol
Monoisotopic Mass:
349.189g/mol
Rotatable Bond Count:
7  
Topological Polar Surface Area:
65.1A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
3.6  
Properties