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138007-24-6 | 4-Piperidinecarboxylic acid, 1,1-dimethylethyl ester
CAS No: 138007-24-6 Catalog No: AG0017TN MDL No:MFCD02684429
Product Description
Catalog Number:
AG0017TN
Chemical Name:
4-Piperidinecarboxylic acid, 1,1-dimethylethyl ester
CAS Number:
138007-24-6
Molecular Formula:
C10H19NO2
Molecular Weight:
185.2634
MDL Number:
MFCD02684429
IUPAC Name:
tert-butyl piperidine-4-carboxylate
InChI:
InChI=1S/C10H19NO2/c1-10(2,3)13-9(12)8-4-6-11-7-5-8/h8,11H,4-7H2,1-3H3
InChI Key:
FUYBPBOHNIHCHM-UHFFFAOYSA-N
SMILES:
O=C(C1CCNCC1)OC(C)(C)C
Properties
Complexity:
178
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
185.142g/mol
Formal Charge:
0
Heavy Atom Count:
13
Hydrogen Bond Acceptor Count:
3
Hydrogen Bond Donor Count:
1
Isotope Atom Count:
0
Molecular Weight:
185.267g/mol
Monoisotopic Mass:
185.142g/mol
Rotatable Bond Count:
3
Topological Polar Surface Area:
38.3A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
1.1
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