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189618-32-4 | Piperidine, 4-[(4-bromophenoxy)methyl]-
CAS No: 189618-32-4 Catalog No: AG002DSV MDL No:
Product Description
Catalog Number:
AG002DSV
Chemical Name:
Piperidine, 4-[(4-bromophenoxy)methyl]-
CAS Number:
189618-32-4
Molecular Formula:
C12H16BrNO
Molecular Weight:
270.1655
IUPAC Name:
4-[(4-bromophenoxy)methyl]piperidine
InChI:
InChI=1S/C12H16BrNO/c13-11-1-3-12(4-2-11)15-9-10-5-7-14-8-6-10/h1-4,10,14H,5-9H2
InChI Key:
RGJFMUFGRNTWRU-UHFFFAOYSA-N
SMILES:
Brc1ccc(cc1)OCC1CCNCC1
Properties
Complexity:
175
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
269.042g/mol
Formal Charge:
0
Heavy Atom Count:
15
Hydrogen Bond Acceptor Count:
2
Hydrogen Bond Donor Count:
1
Isotope Atom Count:
0
Molecular Weight:
270.17g/mol
Monoisotopic Mass:
269.042g/mol
Rotatable Bond Count:
3
Topological Polar Surface Area:
21.3A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
2.9
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