Benzene, 1,3-difluoro-2-isothiocyanato-


Chemical Name: Benzene, 1,3-difluoro-2-isothiocyanato-
CAS Number: 207974-17-2
Product Number: AG002JEE(AGN-PC-0L44OZ)
Synonyms:
MDL No:
Molecular Formula: C7H3F2NS
Molecular Weight: 171.1672

Identification/Properties


Properties
Form:
Liquid
Computed Properties
Molecular Weight:
171.165g/mol
XLogP3:
3.5
Hydrogen Bond Donor Count:
0
Hydrogen Bond Acceptor Count:
4
Rotatable Bond Count:
1
Exact Mass:
170.995g/mol
Monoisotopic Mass:
170.995g/mol
Topological Polar Surface Area:
44.4A^2
Heavy Atom Count:
11
Formal Charge:
0
Complexity:
169
Isotope Atom Count:
0
Defined Atom Stereocenter Count:
0
Undefined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
Covalently-Bonded Unit Count:
1
Compound Is Canonicalized:
Yes

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NMR Spectrum


Other Analytical Data


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