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67074-49-1 | Piperidine, 1-[4-(1,1-dimethylethyl)-1-cyclohexen-1-yl]-
CAS No: 67074-49-1 Catalog No: AG0064DF MDL No:
Product Description
Catalog Number:
AG0064DF
Chemical Name:
Piperidine, 1-[4-(1,1-dimethylethyl)-1-cyclohexen-1-yl]-
CAS Number:
67074-49-1
Molecular Formula:
C15H27N
Molecular Weight:
221.3816
IUPAC Name:
1-(4-tert-butylcyclohexen-1-yl)piperidine
InChI:
InChI=1S/C15H27N/c1-15(2,3)13-7-9-14(10-8-13)16-11-5-4-6-12-16/h9,13H,4-8,10-12H2,1-3H3
InChI Key:
CMMRGJXXSUCCQU-UHFFFAOYSA-N
SMILES:
CC(C1CCC(=CC1)N1CCCCC1)(C)C
Properties
Complexity:
253
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
221.214g/mol
Formal Charge:
0
Heavy Atom Count:
16
Hydrogen Bond Acceptor Count:
1
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
221.388g/mol
Monoisotopic Mass:
221.214g/mol
Rotatable Bond Count:
2
Topological Polar Surface Area:
3.2A^2
Undefined Atom Stereocenter Count:
1
Undefined Bond Stereocenter Count:
0
XLogP3:
4.4
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