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160113-33-7 | Piperidine, 1-[(1S,2R)-2-methyl-1-(2-thienyl)cyclohexyl]-
CAS No: 160113-33-7 Catalog No: AG001RO7 MDL No:
Product Description
Catalog Number:
AG001RO7
Chemical Name:
Piperidine, 1-[(1S,2R)-2-methyl-1-(2-thienyl)cyclohexyl]-
CAS Number:
160113-33-7
Molecular Formula:
C16H25NS
Molecular Weight:
263.4414
IUPAC Name:
1-[(1S,2R)-2-methyl-1-thiophen-2-ylcyclohexyl]piperidine
InChI:
InChI=1S/C16H25NS/c1-14-8-3-4-10-16(14,15-9-7-13-18-15)17-11-5-2-6-12-17/h7,9,13-14H,2-6,8,10-12H2,1H3/t14-,16+/m1/s1
InChI Key:
DKFAAPPUYWQKKF-ZBFHGGJFSA-N
SMILES:
C[C@@H]1CCCC[C@@]1(N1CCCCC1)c1cccs1
Properties
Complexity:
274
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
2
Defined Bond Stereocenter Count:
0
Exact Mass:
263.171g/mol
Formal Charge:
0
Heavy Atom Count:
18
Hydrogen Bond Acceptor Count:
2
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
263.443g/mol
Monoisotopic Mass:
263.171g/mol
Rotatable Bond Count:
2
Topological Polar Surface Area:
31.5A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
4.4
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