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146667-87-0 | 1-Piperidinecarboxylic acid, 3-ethenyl-, 1,1-dimethylethyl ester
CAS No: 146667-87-0 Catalog No: AG001E7S MDL No:MFCD11036129
Product Description
Catalog Number:
AG001E7S
Chemical Name:
1-Piperidinecarboxylic acid, 3-ethenyl-, 1,1-dimethylethyl ester
CAS Number:
146667-87-0
Molecular Formula:
C12H21NO2
Molecular Weight:
211.3006
MDL Number:
MFCD11036129
IUPAC Name:
tert-butyl 3-ethenylpiperidine-1-carboxylate
InChI:
InChI=1S/C12H21NO2/c1-5-10-7-6-8-13(9-10)11(14)15-12(2,3)4/h5,10H,1,6-9H2,2-4H3
InChI Key:
JCQBWMAWTUBARI-UHFFFAOYSA-N
SMILES:
C=CC1CCCN(C1)C(=O)OC(C)(C)C
Properties
Complexity:
243
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
211.157g/mol
Formal Charge:
0
Heavy Atom Count:
15
Hydrogen Bond Acceptor Count:
2
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
211.305g/mol
Monoisotopic Mass:
211.157g/mol
Rotatable Bond Count:
3
Topological Polar Surface Area:
29.5A^2
Undefined Atom Stereocenter Count:
1
Undefined Bond Stereocenter Count:
0
XLogP3:
2.5
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