200,000+ products from a single source!
sales@angenechem.com
Home > Carboxes > 1713163-05-3
1713163-05-3 | 3-Chloro-2,4-difluorophenylisothiocyanate
CAS No: 1713163-05-3 Catalog No: AG01FBPJ MDL No:MFCD26958700
Product Description
Catalog Number:
AG01FBPJ
Chemical Name:
3-Chloro-2,4-difluorophenylisothiocyanate
CAS Number:
1713163-05-3
Molecular Formula:
C7H2ClF2NS
Molecular Weight:
205.6123
MDL Number:
MFCD26958700
IUPAC Name:
2-chloro-1,3-difluoro-4-isothiocyanatobenzene
InChI:
InChI=1S/C7H2ClF2NS/c8-6-4(9)1-2-5(7(6)10)11-3-12/h1-2H
InChI Key:
KUANXYWNTJSWCD-UHFFFAOYSA-N
SMILES:
S=C=Nc1ccc(c(c1F)Cl)F
Properties
Complexity:
208
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
204.956g/mol
Formal Charge:
0
Heavy Atom Count:
12
Hydrogen Bond Acceptor Count:
4
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
205.607g/mol
Monoisotopic Mass:
204.956g/mol
Rotatable Bond Count:
1
Topological Polar Surface Area:
44.4A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
4.2
Related Products
© 2019 Angene International Limited. All rights Reserved.