AG0038NP

54681-68-4 | 5-Bromo-3-methyl-1,2,4-thiadiazole

AG0038NP

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CAS Number	54681-68-4
Catalog Number	AG0038NP(AGN-PC-00K33T)
Chemical Name	5-Bromo-3-methyl-1,2,4-thiadiazole
IUPAC Name	5-bromo-3-methyl-1,2,4-thiadiazole
InChI	InChI=1S/C3H3BrN2S/c1-2-5-3(4)7-6-2/h1H3
InChI Key	LRFYFSQFLKUMEP-UHFFFAOYSA-N
MDL Number	MFCD11847500
Molecular Formula	C3H3BrN2S
Molecular Weight	179.0383
SMILES	BrC1=NC(=NS1)C
Synonyms	5-BROMO-3-METHYL-1,2,4-THIADIAZOLE, 54681-68-4, SCHEMBL2730482, CTK8C1609, DTXSID90512945, LRFYFSQFLKUMEP-UHFFFAOYSA-N, KS-00000QM9, 7937AB, ANW-66971, MFCD11847500, ZINC39340641, 3-methyl-5-bromo-1,2,4-thiadiazole, AKOS014320085, NE48863, 5-bromo-3-methyl-[1,2,4]thiadiazole, AJ-99915, AK-90235, DS-16816, SC-23368, AB0049067, ST2411836, TC-155716, 4CH-016573, CS-0028376, FT-0699632, C3H3BrN2S,

Complexity	70
Compound Is Canonicalized	Yes
Covalently-Bonded Unit Count	1
Defined Atom Stereocenter Count	0
Defined Bond Stereocenter Count	0
Exact Mass	177.92g/mol
Formal Charge	0
Heavy Atom Count	7
Hydrogen Bond Acceptor Count	3
Hydrogen Bond Donor Count	0
Isotope Atom Count	0
Molecular Weight	179.035g/mol
Monoisotopic Mass	177.92g/mol
Rotatable Bond Count	0
Topological Polar Surface Area	54A^2
Undefined Atom Stereocenter Count	0
Undefined Bond Stereocenter Count	0
XLogP3	2.3

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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