Home Carboxys 1-Piperidinecarboxylic acid, 4-(2-iodoethyl)-, 1,1-dimethylethyl ester

1-Piperidinecarboxylic acid, 4-(2-iodoethyl)-, 1,1-dimethylethyl ester

CAS No.:
89151-46-2
Catalog Number:
AG0075RD
Molecular Formula:
C12H22INO2
Molecular Weight:
339.2131
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Product Description
Catalog Number:
AG0075RD
Chemical Name:
1-Piperidinecarboxylic acid, 4-(2-iodoethyl)-, 1,1-dimethylethyl ester
CAS Number:
89151-46-2
Molecular Formula:
C12H22INO2
Molecular Weight:
339.2131
MDL Number:
MFCD17171250
IUPAC Name:
tert-butyl 4-(2-iodoethyl)piperidine-1-carboxylate
InChI:
InChI=1S/C12H22INO2/c1-12(2,3)16-11(15)14-8-5-10(4-7-13)6-9-14/h10H,4-9H2,1-3H3
InChI Key:
IONMNRHLZXJDJX-UHFFFAOYSA-N
SMILES:
ICCC1CCN(CC1)C(=O)OC(C)(C)C
Properties
Complexity:
230  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
339.07g/mol
Formal Charge:
0
Heavy Atom Count:
16  
Hydrogen Bond Acceptor Count:
2  
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
339.217g/mol
Monoisotopic Mass:
339.07g/mol
Rotatable Bond Count:
4  
Topological Polar Surface Area:
29.5A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
3.7  
Properties