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Home Other Building Blocks 1-(2-Fluorophenyl)piperazine

1-(2-Fluorophenyl)piperazine

CAS No.:
1011-15-0
Catalog Number:
AG0003R3
Molecular Formula:
C10H13FN2
Molecular Weight:
180.2220
Pack Size
Purity
Availability
Location
Price(USD)
Quantity
  
5g
98%
In Stock USA
United States
$19
- +
25g
98%
In Stock USA
United States
$75
- +
100g
98%
In Stock USA
United States
$200
- +
500g
95%
In Stock USA
United States
$644
- +
Product Description
Catalog Number:
AG0003R3
Chemical Name:
1-(2-Fluorophenyl)piperazine
CAS Number:
1011-15-0
Molecular Formula:
C10H13FN2
Molecular Weight:
180.2220
MDL Number:
MFCD00040726
IUPAC Name:
1-(2-fluorophenyl)piperazine
InChI:
InChI=1S/C10H13FN2/c11-9-3-1-2-4-10(9)13-7-5-12-6-8-13/h1-4,12H,5-8H2
InChI Key:
IVTZRJKKXSKXKO-UHFFFAOYSA-N
SMILES:
Fc1ccccc1N1CCNCC1
EC Number:
213-780-4
Properties
Complexity:
157  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
180.106g/mol
Formal Charge:
0
Heavy Atom Count:
13  
Hydrogen Bond Acceptor Count:
3  
Hydrogen Bond Donor Count:
1  
Isotope Atom Count:
0
Molecular Weight:
180.226g/mol
Monoisotopic Mass:
180.106g/mol
Rotatable Bond Count:
1  
Topological Polar Surface Area:
15.3A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
1.5  
Literature
Title Journal
12-{[4-(2-Fluoro-phen-yl)piperazin-1-yl]-meth-yl}-9α-hy-droxy-4,8-dimethyl-3,14-dioxatricyclo-[9.3.0.0]tetra-dec-7-en-13-one. Acta crystallographica. Section E, Structure reports online 20120301
2-Chloro-1-[4-(2-fluoro-benz-yl)piperazin-1-yl]ethanone. Acta crystallographica. Section E, Structure reports online 20110301
Identification of a chemical probe for NAADP by virtual screening. Nature chemical biology 20090401
Prediction of genotoxicity of chemical compounds by statistical learning methods. Chemical research in toxicology 20050601
Properties