AG00802T

1341405-19-3 | 4-(5-Bromo[1,3,4]thiadiazol-2-yl)morpholine

AG00802T

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CAS Number	1341405-19-3
Catalog Number	AG00802T(AGN-PC-0BL83P)
Chemical Name	4-(5-Bromo[1,3,4]thiadiazol-2-yl)morpholine
IUPAC Name	4-(5-bromo-1,3,4-thiadiazol-2-yl)morpholine
InChI	InChI=1S/C6H8BrN3OS/c7-5-8-9-6(12-5)10-1-3-11-4-2-10/h1-4H2
InChI Key	KNPRIAYJCRBMHL-UHFFFAOYSA-N
MDL Number	MFCD12923103
Molecular Formula	C6H8BrN3OS
Molecular Weight	250.1162
SMILES	BrC1=NN=C(S1)N2CCOCC2
Synonyms	4-(5-bromo-1,3,4-thiadiazol-2-yl)morpholine, 1341405-19-3, 4-(5-Bromo[1,3,4]thiadiazol-2-yl)morpholine, C6H8BrN3OS, bromothiadiazolylmorpholine, CTK8B5795, DTXSID40719205, KS-00000OT9, ANW-50132, MFCD12923103, ZINC72119994, AKOS013950814, AG-0001, MCULE-4737430191, RP14243, AK-28537, BR-28537, CJ-21633, AB0035510, AJ-119046, TC-138877, 4CH-010530, ST24023180, X9870, S-6923,

Complexity	156
Compound Is Canonicalized	Yes
Covalently-Bonded Unit Count	1
Defined Atom Stereocenter Count	0
Defined Bond Stereocenter Count	0
Exact Mass	248.957g/mol
Formal Charge	0
Heavy Atom Count	12
Hydrogen Bond Acceptor Count	5
Hydrogen Bond Donor Count	0
Isotope Atom Count	0
Molecular Weight	250.114g/mol
Monoisotopic Mass	248.957g/mol
Rotatable Bond Count	1
Topological Polar Surface Area	66.5A^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-H332-H335
Packing Group
Precautionary statements	P261-P280-P305+P351+P338
UN Code

Certificate of Analysis

Lot Number