Home Other Building Blocks 1,2-difluoro-4-(isocyanatomethyl)benzene

1,2-difluoro-4-(isocyanatomethyl)benzene

CAS No.:
866538-73-0
Catalog Number:
AG01AUXF
Molecular Formula:
C8H5F2NO
Molecular Weight:
169.1282
Pack Size
Purity
Availability
Location
Price(USD)
Quantity
  
Product Description
Catalog Number:
AG01AUXF
Chemical Name:
1,2-difluoro-4-(isocyanatomethyl)benzene
CAS Number:
866538-73-0
Molecular Formula:
C8H5F2NO
Molecular Weight:
169.1282
MDL Number:
MFCD18269786
IUPAC Name:
1,2-difluoro-4-(isocyanatomethyl)benzene
InChI:
InChI=1S/C8H5F2NO/c9-7-2-1-6(3-8(7)10)4-11-5-12/h1-3H,4H2
InChI Key:
DIZUMMHPEYKKJL-UHFFFAOYSA-N
SMILES:
O=C=NCc1ccc(c(c1)F)F
Properties
Complexity:
192  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
169.034g/mol
Formal Charge:
0
Heavy Atom Count:
12  
Hydrogen Bond Acceptor Count:
4  
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
169.131g/mol
Monoisotopic Mass:
169.034g/mol
Rotatable Bond Count:
2  
Topological Polar Surface Area:
29.4A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
2.9  
Properties