Home Other Building Blocks 2-Fluoro-4-thiocyanatoaniline

2-Fluoro-4-thiocyanatoaniline

CAS No.:
14512-85-7
Catalog Number:
AG001KL4
Molecular Formula:
C7H5FN2S
Molecular Weight:
168.1914
Pack Size
Purity
Availability
Location
Price(USD)
Quantity
  
1g
98%
In Stock USA
United States
$150
- +
5g
98%
In Stock USA
United States
$450
- +
25g
98%
In Stock USA
United States
$1150
- +
Product Description
Catalog Number:
AG001KL4
Chemical Name:
2-Fluoro-4-thiocyanatoaniline
CAS Number:
14512-85-7
Molecular Formula:
C7H5FN2S
Molecular Weight:
168.1914
MDL Number:
MFCD04617227
IUPAC Name:
(4-amino-3-fluorophenyl) thiocyanate
InChI:
InChI=1S/C7H5FN2S/c8-6-3-5(11-4-9)1-2-7(6)10/h1-3H,10H2
InChI Key:
RPLHGFNIWGHYMX-UHFFFAOYSA-N
SMILES:
N#CSc1ccc(c(c1)F)N
Properties
Complexity:
177  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
168.016g/mol
Formal Charge:
0
Heavy Atom Count:
11  
Hydrogen Bond Acceptor Count:
4  
Hydrogen Bond Donor Count:
1  
Isotope Atom Count:
0
Molecular Weight:
168.189g/mol
Monoisotopic Mass:
168.016g/mol
Rotatable Bond Count:
1  
Topological Polar Surface Area:
75.1A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
2  
Properties