Home Other Building Blocks 2-Fluoro-4-isocyanato-1-methylbenzene

2-Fluoro-4-isocyanato-1-methylbenzene

CAS No.:
102561-42-2
Catalog Number:
AG0007PG
Molecular Formula:
C8H6FNO
Molecular Weight:
151.1377
Pack Size
Purity
Availability
Location
Price(USD)
Quantity
  
1g
98%
In Stock USA
United States
$38
- +
5g
98%
In Stock USA
United States
$157
- +
25g
98%
In Stock USA
United States
$469
- +
Product Description
Catalog Number:
AG0007PG
Chemical Name:
2-Fluoro-4-isocyanato-1-methylbenzene
CAS Number:
102561-42-2
Molecular Formula:
C8H6FNO
Molecular Weight:
151.1377
MDL Number:
MFCD00037071
IUPAC Name:
2-fluoro-4-isocyanato-1-methylbenzene
InChI:
InChI=1S/C8H6FNO/c1-6-2-3-7(10-5-11)4-8(6)9/h2-4H,1H3
InChI Key:
FWRCOINKYLERQL-UHFFFAOYSA-N
SMILES:
O=C=Nc1ccc(c(c1)F)C
Properties
Complexity:
177  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
151.043g/mol
Formal Charge:
0
Heavy Atom Count:
11  
Hydrogen Bond Acceptor Count:
3  
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
151.14g/mol
Monoisotopic Mass:
151.043g/mol
Rotatable Bond Count:
1  
Topological Polar Surface Area:
29.4A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
3.2  
Properties