AG007944

365996-07-2 | 2-Bromo-4,5,6,7-Tetrahydrothiazolo[5,4-C]Pyridine

AG007944

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CAS Number	365996-07-2
Catalog Number	AG007944(AGN-PC-01LR5L)
Chemical Name	2-Bromo-4,5,6,7-Tetrahydrothiazolo[5,4-C]Pyridine
IUPAC Name	2-bromo-4,5,6,7-tetrahydro-[1,3]thiazolo[5,4-c]pyridine
InChI	InChI=1S/C6H7BrN2S/c7-6-9-4-1-2-8-3-5(4)10-6/h8H,1-3H2
InChI Key	UIBFPUKBRPPEBC-UHFFFAOYSA-N
MDL Number	MFCD08448172
Molecular Formula	C6H7BrN2S
Molecular Weight	219.1022
SMILES	BrC1=NC2=C(CNCC2)S1
Synonyms	2-Bromo-4,5,6,7-tetrahydrothiazolo[5,4-c]pyridine, 365996-07-2, Thiazolo[5,4-c]pyridine, 2-bromo-4,5,6,7-tetrahydro-, 2-bromo-4,5,6,7-tetrahydro-Thiazolo[5,4-c]pyridine, SCHEMBL765291, CTK1C0721, ANW-56219, MFCD08703285, ZINC30678269, AKOS016001121, AB48472, FCH1388018, AJ-84030, AK-30605, AX8223937, DB-069407, TC-144964, CS-0060817, FT-0646151, ST24040092, 996B072, 2-bromo-4H,5H,6H,7H-[1,3]thiazolo[5,4-c]pyridine, 2-Bromo-4,5,6,7-tetrahydro-[1,3]thiazolo[5,4-c]pyridine, 2-Bromo-4,5,6,7-tetrahydrothiazolo[5,4-c]pyridine hydrochloride,

Complexity	133
Compound Is Canonicalized	Yes
Covalently-Bonded Unit Count	1
Defined Atom Stereocenter Count	0
Defined Bond Stereocenter Count	0
Exact Mass	217.951g/mol
Formal Charge	0
Heavy Atom Count	10
Hydrogen Bond Acceptor Count	3
Hydrogen Bond Donor Count	1
Isotope Atom Count	0
Molecular Weight	219.1g/mol
Monoisotopic Mass	217.951g/mol
Rotatable Bond Count	0
Topological Polar Surface Area	53.2A^2
Undefined Atom Stereocenter Count	0
Undefined Bond Stereocenter Count	0
XLogP3	1.5

GHS Hazard and Precautionary Statements

Symbol:
Hazard Class
Hazard statements	H302-H315-H319-H335
Packing Group
Precautionary statements	P261-P305+P351+P338
UN Code

Certificate of Analysis

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