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Home > Thiazole > 1017347-14-6
1017347-14-6 | 4-[(4-tert-butyl-1,3-thiazol-2-yl)methyl]piperidine
CAS No: 1017347-14-6 Catalog No: AG01B8TN MDL No:MFCD09891839
Product Description
Catalog Number:
AG01B8TN
Chemical Name:
4-[(4-tert-butyl-1,3-thiazol-2-yl)methyl]piperidine
CAS Number:
1017347-14-6
Molecular Formula:
C13H22N2S
Molecular Weight:
238.3922
MDL Number:
MFCD09891839
IUPAC Name:
4-tert-butyl-2-(piperidin-4-ylmethyl)-1,3-thiazole
InChI:
InChI=1S/C13H22N2S/c1-13(2,3)11-9-16-12(15-11)8-10-4-6-14-7-5-10/h9-10,14H,4-8H2,1-3H3
InChI Key:
PCCPFHSABLIORN-UHFFFAOYSA-N
SMILES:
CC(c1csc(n1)CC1CCNCC1)(C)C
Properties
Complexity:
219
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
238.15g/mol
Formal Charge:
0
Heavy Atom Count:
16
Hydrogen Bond Acceptor Count:
3
Hydrogen Bond Donor Count:
1
Isotope Atom Count:
0
Molecular Weight:
238.393g/mol
Monoisotopic Mass:
238.15g/mol
Rotatable Bond Count:
3
Topological Polar Surface Area:
53.2A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
3.3
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