AG01AALA

Name: 1,3-dichloro-2-isothiocyanato-4-methylbenzene
Brand: Angene Chemical
SKU: AG01AALA

1036587-85-5 | 1,3-dichloro-2-isothiocyanato-4-methylbenzene

AG01AALA

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CAS Number	1036587-85-5
Catalog Number	AG01AALA
Chemical Name	1,3-dichloro-2-isothiocyanato-4-methylbenzene
IUPAC Name	1,3-dichloro-2-isothiocyanato-4-methylbenzene
InChI	InChI=1S/C8H5Cl2NS/c1-5-2-3-6(9)8(7(5)10)11-4-12/h2-3H,1H3
InChI Key	OFERGZYJXXNVDN-UHFFFAOYSA-N
MDL Number	MFCD11117350
Molecular Formula	C8H5Cl2NS
Molecular Weight	218.1030
SMILES	CC1=C(Cl)C(N=C=S)=C(Cl)C=C1
Synonyms	1,3-dichloro-2-isothiocyanato-4-methylbenzene, 1036587-85-5, AC1Q2F3K, ZINC20545879, AKOS009175053, EN300-68924,

Complexity	203
Compound Is Canonicalized	Yes
Covalently-Bonded Unit Count	1
Defined Atom Stereocenter Count	0
Defined Bond Stereocenter Count	0
Exact Mass	216.952g/mol
Formal Charge	0
Heavy Atom Count	12
Hydrogen Bond Acceptor Count	2
Hydrogen Bond Donor Count	0
Isotope Atom Count	0
Molecular Weight	218.095g/mol
Monoisotopic Mass	216.952g/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