AG004QSZ

848499-31-0 | 2-Bromothiazole-5-carboxamide

AG004QSZ

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CAS Number	848499-31-0
Catalog Number	AG004QSZ(AGN-PC-02SC2K)
Chemical Name	2-Bromothiazole-5-carboxamide
IUPAC Name	2-bromo-1,3-thiazole-5-carboxamide
InChI	InChI=1S/C4H3BrN2OS/c5-4-7-1-2(9-4)3(6)8/h1H,(H2,6,8)
InChI Key	RXTGRIUBDYHCKY-UHFFFAOYSA-N
MDL Number	MFCD09998942
Molecular Formula	C4H3BrN2OS
Molecular Weight	207.0484
SMILES	O=C(C1=CN=C(Br)S1)N
Synonyms	2-bromothiazole-5-carboxamide, 848499-31-0, 2-BROMO-THIAZOLE-5-CARBOXAMIDE, 2-Bromo-1,3-thiazole-5-carboxamide, AK-48537, 2-bromo-thiazol-5-carboxamide, SCHEMBL1238343, 5-Thiazolecarboxamide,2-bromo-, CTK5F3271, 5-Thiazolecarboxamide, 2-bromo-, DTXSID00605514, RXTGRIUBDYHCKY-UHFFFAOYSA-N, ANW-48156, MFCD09998942, ZINC59952324, AKOS015919524, FCH1397479, MB08396, QC-6433, BR-48537, DS-14707, SC-45106, AJ-113782, AX8072327, DB-076145, ST2416645, TC-136901, 4CH-003985, FT-0660521, W8754, A23314, S-4729, C4H3BrN2OS,

Complexity	132
Compound Is Canonicalized	Yes
Covalently-Bonded Unit Count	1
Defined Atom Stereocenter Count	0
Defined Bond Stereocenter Count	0
Exact Mass	205.915g/mol
Formal Charge	0
Heavy Atom Count	9
Hydrogen Bond Acceptor Count	3
Hydrogen Bond Donor Count	1
Isotope Atom Count	0
Molecular Weight	207.045g/mol
Monoisotopic Mass	205.915g/mol
Rotatable Bond Count	1
Topological Polar Surface Area	84.2A^2
Undefined Atom Stereocenter Count	0
Undefined Bond Stereocenter Count	0
XLogP3	1.2

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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