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204513-61-1 | Piperidine, 1-(4-bromo-2-thiazolyl)-
CAS No: 204513-61-1 Catalog No: AG0029K2 MDL No:MFCD09607695
Product Description
Catalog Number:
AG0029K2
Chemical Name:
Piperidine, 1-(4-bromo-2-thiazolyl)-
CAS Number:
204513-61-1
Molecular Formula:
C8H11BrN2S
Molecular Weight:
247.1553
MDL Number:
MFCD09607695
IUPAC Name:
4-bromo-2-piperidin-2-yl-1,3-thiazole
InChI:
InChI=1S/C8H11BrN2S/c9-7-5-12-8(11-7)6-3-1-2-4-10-6/h5-6,10H,1-4H2
InChI Key:
AIAUXAGHUAQDFS-UHFFFAOYSA-N
SMILES:
Brc1csc(n1)N1CCCCC1
Properties
Complexity:
156
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
245.983g/mol
Formal Charge:
0
Heavy Atom Count:
12
Hydrogen Bond Acceptor Count:
3
Hydrogen Bond Donor Count:
1
Isotope Atom Count:
0
Molecular Weight:
247.154g/mol
Monoisotopic Mass:
245.983g/mol
Rotatable Bond Count:
1
Topological Polar Surface Area:
53.2A^2
Undefined Atom Stereocenter Count:
1
Undefined Bond Stereocenter Count:
0
XLogP3:
2.3
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