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Home Other Building Blocks 1-(2-Bromophenoxy)-3-(piperidin-1-yl)propan-2-ol

1-(2-Bromophenoxy)-3-(piperidin-1-yl)propan-2-ol

CAS No.:
100794-31-8
Catalog Number:
AG0002WB
Molecular Formula:
C14H20BrNO2
Molecular Weight:
314.2181
Pack Size
Purity
Availability
Location
Price(USD)
Quantity
  
1g
95%
In Stock USA
United States
$96
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Product Description
Catalog Number:
AG0002WB
Chemical Name:
1-(2-Bromophenoxy)-3-(piperidin-1-yl)propan-2-ol
CAS Number:
100794-31-8
Molecular Formula:
C14H20BrNO2
Molecular Weight:
314.2181
MDL Number:
MFCD03670777
IUPAC Name:
1-(2-bromophenoxy)-3-piperidin-1-ylpropan-2-ol
InChI:
InChI=1S/C14H20BrNO2/c15-13-6-2-3-7-14(13)18-11-12(17)10-16-8-4-1-5-9-16/h2-3,6-7,12,17H,1,4-5,8-11H2
InChI Key:
KLBCAIPPVSRHBK-UHFFFAOYSA-N
SMILES:
OC(CN1CCCCC1)COc1ccccc1Br
Properties
Complexity:
234  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
313.068g/mol
Formal Charge:
0
Heavy Atom Count:
18  
Hydrogen Bond Acceptor Count:
3  
Hydrogen Bond Donor Count:
1  
Isotope Atom Count:
0
Molecular Weight:
314.223g/mol
Monoisotopic Mass:
313.068g/mol
Rotatable Bond Count:
5  
Topological Polar Surface Area:
32.7A^2
Undefined Atom Stereocenter Count:
1  
Undefined Bond Stereocenter Count:
0
XLogP3:
2.8  
Properties