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Home Other Building Blocks 4-Fluorobenzylurea

4-Fluorobenzylurea

CAS No.:
76523-24-5
Catalog Number:
AG003LFB
Molecular Formula:
C8H9FN2O
Molecular Weight:
168.1683
Pack Size
Purity
Availability
Location
Price(USD)
Quantity
  
1g
95%
In Stock USA
United States
$44
- +
5g
95%
In Stock USA
United States
$170
- +
Product Description
Catalog Number:
AG003LFB
Chemical Name:
4-Fluorobenzylurea
CAS Number:
76523-24-5
Molecular Formula:
C8H9FN2O
Molecular Weight:
168.1683
MDL Number:
MFCD00085086
IUPAC Name:
(4-fluorophenyl)methylurea
InChI:
InChI=1S/C8H9FN2O/c9-7-3-1-6(2-4-7)5-11-8(10)12/h1-4H,5H2,(H3,10,11,12)
InChI Key:
ISIFPVOJHJASJW-UHFFFAOYSA-N
SMILES:
NC(=O)NCc1ccc(cc1)F
Properties
Complexity:
155  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
168.07g/mol
Formal Charge:
0
Heavy Atom Count:
12  
Hydrogen Bond Acceptor Count:
2  
Hydrogen Bond Donor Count:
2  
Isotope Atom Count:
0
Molecular Weight:
168.171g/mol
Monoisotopic Mass:
168.07g/mol
Rotatable Bond Count:
2  
Topological Polar Surface Area:
55.1A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
0.8  
Literature
Title Journal
Identifying structural features on 1,1-diphenyl-hexahydro-oxazolo[3,4-a]pyrazin-3-ones critical for Neuropeptide S antagonist activity. Bioorganic & medicinal chemistry letters 20080715
Microsphere-based protease assays and screening application for lethal factor and factor Xa. Cytometry. Part A : the journal of the International Society for Analytical Cytology 20060501
Properties