AG00224Y

180597-85-7 | Thiazole, 2-bromo-4-(bromomethyl)-

AG00224Y

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CAS Number	180597-85-7
Catalog Number	AG00224Y(AGN-PC-09Q667)
Chemical Name	Thiazole, 2-bromo-4-(bromomethyl)-
IUPAC Name	2-bromo-4-(bromomethyl)-1,3-thiazole
InChI	InChI=1S/C4H3Br2NS/c5-1-3-2-8-4(6)7-3/h2H,1H2
InChI Key	PUUHOIJJZAGFNK-UHFFFAOYSA-N
MDL Number	MFCD08273952
Molecular Formula	C4H3Br2NS
Molecular Weight	256.9463
SMILES	BrCC1=CSC(Br)=N1
Synonyms	2-Bromo-4-(bromomethyl)thiazole, 180597-85-7, 2-Bromo-4-bromomethyl-thiazole, 2-bromo-4-(bromomethyl)-1,3-thiazole, SCHEMBL1230092, CTK8C6747, DTXSID90693364, PUUHOIJJZAGFNK-UHFFFAOYSA-N, 9469AA, MFCD08273952, ZINC72233174, Thiazole, 2-bromo-4-(bromomethyl)-, AKOS015900729, CB-3179, FCH1386583, QC-6162, AK118977, 2-Bromo-4-bromomethyl-thiazole, AldrichCPR, AJ-120838, AX8244393, I14-15997, C4H3Br2NS, ACN-047892, N/A,

Complexity	80.4
Compound Is Canonicalized	Yes
Covalently-Bonded Unit Count	1
Defined Atom Stereocenter Count	0
Defined Bond Stereocenter Count	0
Exact Mass	256.833g/mol
Formal Charge	0
Heavy Atom Count	8
Hydrogen Bond Acceptor Count	2
Hydrogen Bond Donor Count	0
Isotope Atom Count	0
Molecular Weight	256.943g/mol
Monoisotopic Mass	254.835g/mol
Rotatable Bond Count	1
Topological Polar Surface Area	41.1A^2
Undefined Atom Stereocenter Count	0
Undefined Bond Stereocenter Count	0
XLogP3	2.6

GHS Hazard and Precautionary Statements

Symbol:
Hazard Class
Hazard statements	H302-H315-H319-H332-H335
Packing Group
Precautionary statements	P280-P305+P351+P338-P310
UN Code

Certificate of Analysis

Lot Number