AG005AQ6

74585-98-1 | Quinoline-4-carbothioamide

AG005AQ6

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CAS Number	74585-98-1
Catalog Number	AG005AQ6(AGN-PC-0LQFQU)
Chemical Name	Quinoline-4-carbothioamide
IUPAC Name	quinoline-4-carbothioamide
InChI	InChI=1S/C10H8N2S/c11-10(13)8-5-6-12-9-4-2-1-3-7(8)9/h1-6H,(H2,11,13)
InChI Key	CVBYCKKBOIJRTK-UHFFFAOYSA-N
MDL Number	MFCD02179220
Molecular Formula	C10H8N2S
Molecular Weight	188.2489
SMILES	S=C(C1=CC=NC2=CC=CC=C12)N
Synonyms	quinoline-4-carbothioamide, 74585-98-1, Quinoline-4-carbothioic acid amide, 4-Quinolinecarbothioamide, 4-Thiocarbamylquinoline, QUINOLINE-4-CARBOTHIOICACIDAMIDE, AC1NT9CU, AC1Q4ZZO, 4-Quinolinethiocarboxamide, Quinoline-4-thiocarboxamide, 4-Quinolinecarbothioamide #, SCHEMBL11157581, CTK2H6384, DTXSID30418750, CVBYCKKBOIJRTK-UHFFFAOYSA-N, ANW-61400, MFCD02179220, ZINC14808505, 4-Quinolinecarbothioamide, AldrichCPR, AKOS013180581, AB11047, RP03612, AJ-65463, DB-074851, TC-069590, FT-0083300, FT-0651359, Y5541, A25994, C-1392, I08-0357, J-524192, C10H8N2S, ACN-039004, CID5375102, quinoline-4-carbothioamide, 95% - 1G 1g,

Complexity	205
Compound Is Canonicalized	Yes
Covalently-Bonded Unit Count	1
Defined Atom Stereocenter Count	0
Defined Bond Stereocenter Count	0
Exact Mass	188.041g/mol
Formal Charge	0
Heavy Atom Count	13
Hydrogen Bond Acceptor Count	2
Hydrogen Bond Donor Count	1
Isotope Atom Count	0
Molecular Weight	188.248g/mol
Monoisotopic Mass	188.041g/mol
Rotatable Bond Count	1
Topological Polar Surface Area	71A^2
Undefined Atom Stereocenter Count	0
Undefined Bond Stereocenter Count	0
XLogP3	0.4

GHS Hazard and Precautionary Statements

Symbol:
Hazard Class
Hazard statements	H317-H319
Packing Group
Precautionary statements	P280-P305+P351+P338
UN Code

Certificate of Analysis

Lot Number