200,000+ products from a single source!
sales@angenechem.com
Home > Fluorides > 102561-42-2
102561-42-2 | Benzene, 2-fluoro-4-isocyanato-1-methyl-
CAS No: 102561-42-2 Catalog No: AG0007PG MDL No:MFCD00037071
Product Description
Catalog Number:
AG0007PG
Chemical Name:
Benzene, 2-fluoro-4-isocyanato-1-methyl-
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
Related Products
Featured Products
© 2019 Angene International Limited. All rights Reserved.