AG00IFX6

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CAS Number	899806-25-8
Catalog Number	AG00IFX6(AGN-PC-0NMPHF)
Chemical Name	Benzene, 1-chloro-3-fluoro-2-isothiocyanato-
IUPAC Name	1-chloro-3-fluoro-2-isothiocyanatobenzene
InChI	InChI=1S/C7H3ClFNS/c8-5-2-1-3-6(9)7(5)10-4-11/h1-3H
InChI Key	DFQHWRCYXUNZDH-UHFFFAOYSA-N
MDL Number	MFCD09878160
Molecular Formula	C7H3ClFNS
Molecular Weight	187.6218
SMILES	FC1=C(N=C=S)C(Cl)=CC=C1
Synonyms	899806-25-8, 2-Chloro-6-fluorophenylisothiocyanate, 1-Chloro-3-fluoro-2-isothiocyanatobenzene, 2-chloro-6-fluorophenyl isothiocyanate, Benzene, 1-chloro-3-fluoro-2-isothiocyanato-, 1-Chloro-3-fluoro-2-isothiocyanato-benzene, SCHEMBL158972, CTK8E3961, DTXSID00650246, DFQHWRCYXUNZDH-UHFFFAOYSA-N, MFCD09878160, ZINC15444529, AKOS006310148, AS04460, FS-4364, 1-chloro-3-fluoro-2-isothio-cyanatobenzene, RT-018960, FT-0719122, J-504506,

Complexity	181
Compound Is Canonicalized	Yes
Covalently-Bonded Unit Count	1
Defined Atom Stereocenter Count	0
Defined Bond Stereocenter Count	0
Exact Mass	186.966g/mol
Formal Charge	0
Heavy Atom Count	11
Hydrogen Bond Acceptor Count	3
Hydrogen Bond Donor Count	0
Isotope Atom Count	0
Molecular Weight	187.616g/mol
Monoisotopic Mass	186.966g/mol
Rotatable Bond Count	1
Topological Polar Surface Area	44.4A^2
Undefined Atom Stereocenter Count	0
Undefined Bond Stereocenter Count	0
XLogP3	4.1

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CERTIFICATE OF ANALYSIS

Analysis Data:

Test:

Result:

Conclusion: The above product meets the specifications of Angene.

Analyst:Chase

Date:

Reviewed by:Jessie

Date:

Angene International Limited