AG00CZ3N

Name: 2-(4-Isothiocyanatophenyl)-6-methyl-1,3-benzothiazole
Brand: Angene Chemical
SKU: AG00CZ3N

38985-69-2 | 2-(4-Isothiocyanatophenyl)-6-methyl-1,3-benzothiazole

AG00CZ3N

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CAS Number	38985-69-2
Catalog Number	AG00CZ3N(AGN-PC-0KKU3Y)
Chemical Name	2-(4-Isothiocyanatophenyl)-6-methyl-1,3-benzothiazole
IUPAC Name	2-(4-isothiocyanatophenyl)-6-methyl-1,3-benzothiazole
InChI	InChI=1S/C15H10N2S2/c1-10-2-7-13-14(8-10)19-15(17-13)11-3-5-12(6-4-11)16-9-18/h2-8H,1H3
InChI Key	LDZBSJGNFLWZNJ-UHFFFAOYSA-N
MDL Number	MFCD03147412
Molecular Formula	C15H10N2S2
Molecular Weight	282.3833
SMILES	CC1=CC2=C(N=C(C3=CC=C(N=C=S)C=C3)S2)C=C1
Synonyms	38985-69-2, 2-(4-Isothiocyanato-phenyl)-6-methyl-benzothiazole, 2-(4-isothiocyanatophenyl)-6-methyl-1,3-benzothiazole, AC1MCJSV, AC1Q2O2U, CTK4I0783, DTXSID60377927, ZINC6550122, STL451623, AKOS001106710, NE18977, EN300-01255, Benzothiazole,2-(4-isothiocyanatophenyl)-6-methyl-, ZINC06550122, CID2771335,

Complexity	359
Compound Is Canonicalized	Yes
Covalently-Bonded Unit Count	1
Defined Atom Stereocenter Count	0
Defined Bond Stereocenter Count	0
Exact Mass	282.029g/mol
Formal Charge	0
Heavy Atom Count	19
Hydrogen Bond Acceptor Count	4
Hydrogen Bond Donor Count	0
Isotope Atom Count	0
Molecular Weight	282.379g/mol
Monoisotopic Mass	282.029g/mol
Rotatable Bond Count	2
Topological Polar Surface Area	85.6A^2
Undefined Atom Stereocenter Count	0
Undefined Bond Stereocenter Count	0
XLogP3	6

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