Home Other Building Blocks N-Boc-4-isothiocyanatoaniline

N-Boc-4-isothiocyanatoaniline

CAS No.:
89631-75-4
Catalog Number:
AG003STH
Molecular Formula:
Molecular Weight:
Pack Size
Purity
Availability
Location
Price(USD)
Quantity
  
250mg
95%
In Stock USA
United States
$128
- +
Product Description
Catalog Number:
AG003STH
Chemical Name:
N-Boc-4-isothiocyanatoaniline
CAS Number:
89631-75-4
MDL Number:
MFCD01862957
IUPAC Name:
tert-butyl N-(4-isothiocyanatophenyl)carbamate
InChI:
InChI=1S/C12H14N2O2S/c1-12(2,3)16-11(15)14-10-6-4-9(5-7-10)13-8-17/h4-7H,1-3H3,(H,14,15)
InChI Key:
KMOFDGFIFPIQCT-UHFFFAOYSA-N
Properties
Complexity:
311  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
250.078g/mol
Formal Charge:
0
Heavy Atom Count:
17  
Hydrogen Bond Acceptor Count:
4  
Hydrogen Bond Donor Count:
1  
Isotope Atom Count:
0
Molecular Weight:
250.316g/mol
Monoisotopic Mass:
250.078g/mol
Rotatable Bond Count:
4  
Topological Polar Surface Area:
82.8A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
3.9  
Properties