AG00JCII

Name: 1-Chloro-4-isothiocyanato-2-methylbenzene
Brand: Angene Chemical
SKU: AG00JCII

23163-92-0 | 1-Chloro-4-isothiocyanato-2-methylbenzene

AG00JCII

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CAS Number	23163-92-0
Catalog Number	AG00JCII(AGN-PC-0KKLYH)
Chemical Name	1-Chloro-4-isothiocyanato-2-methylbenzene
IUPAC Name	1-chloro-4-isothiocyanato-2-methylbenzene
InChI	InChI=1S/C8H6ClNS/c1-6-4-7(10-5-11)2-3-8(6)9/h2-4H,1H3
InChI Key	UNEGWYFKUFWKAZ-UHFFFAOYSA-N
MDL Number	MFCD03093794
Molecular Formula	C8H6ClNS
Molecular Weight	183.6579
SMILES	CC1=C(Cl)C=CC(N=C=S)=C1
Synonyms	4-Chloro-3-methylphenyl isothiocyanate, 1-chloro-4-isothiocyanato-2-methylbenzene, 23163-92-0, AC1MBWGF, SCHEMBL11574824, CTK8A7566, DTXSID50374006, ZINC2506728, AKOS006277221, ZINC02506728, CID2757694,

Complexity	177
Compound Is Canonicalized	Yes
Covalently-Bonded Unit Count	1
Defined Atom Stereocenter Count	0
Defined Bond Stereocenter Count	0
Exact Mass	182.991g/mol
Formal Charge	0
Heavy Atom Count	11
Hydrogen Bond Acceptor Count	2
Hydrogen Bond Donor Count	0
Isotope Atom Count	0
Molecular Weight	183.653g/mol
Monoisotopic Mass	182.991g/mol
Rotatable Bond Count	1
Topological Polar Surface Area	44.4A^2
Undefined Atom Stereocenter Count	0
Undefined Bond Stereocenter Count	0
XLogP3	4.9

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