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1146080-20-7 | 1-Piperidinecarboxylic acid, 4-(4-ethenylphenoxy)-, 1,1-dimethylethyl ester
CAS No: 1146080-20-7 Catalog No: AG000ET4 MDL No:
Product Description
Catalog Number:
AG000ET4
Chemical Name:
1-Piperidinecarboxylic acid, 4-(4-ethenylphenoxy)-, 1,1-dimethylethyl ester
CAS Number:
1146080-20-7
Molecular Formula:
C18H25NO3
Molecular Weight:
303.3960
IUPAC Name:
tert-butyl 4-(4-ethenylphenoxy)piperidine-1-carboxylate
InChI:
InChI=1S/C18H25NO3/c1-5-14-6-8-15(9-7-14)21-16-10-12-19(13-11-16)17(20)22-18(2,3)4/h5-9,16H,1,10-13H2,2-4H3
InChI Key:
PKNWHAWRYMDXIF-UHFFFAOYSA-N
SMILES:
C=Cc1ccc(cc1)OC1CCN(CC1)C(=O)OC(C)(C)C
Properties
Complexity:
372
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
303.183g/mol
Formal Charge:
0
Heavy Atom Count:
22
Hydrogen Bond Acceptor Count:
3
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
303.402g/mol
Monoisotopic Mass:
303.183g/mol
Rotatable Bond Count:
5
Topological Polar Surface Area:
38.8A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
4.1
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