AG003M4G

243455-57-4 | 5-(3-Bromophenyl)-1,3-oxazole

AG003M4G

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CAS Number	243455-57-4
Catalog Number	AG003M4G(AGN-PC-0KL7MH)
Chemical Name	5-(3-Bromophenyl)-1,3-oxazole
IUPAC Name	5-(3-bromophenyl)-1,3-oxazole
InChI	InChI=1S/C9H6BrNO/c10-8-3-1-2-7(4-8)9-5-11-6-12-9/h1-6H
InChI Key	GUYZQMXSOVOSIC-UHFFFAOYSA-N
MDL Number	MFCD05668970
Molecular Formula	C9H6BrNO
Molecular Weight	224.0540
SMILES	BrC1=CC=CC(=C1)C1=CN=CO1
Synonyms	5-(3-bromophenyl)-1,3-oxazole, 5-(3-bromophenyl)oxazole, 243455-57-4, 5-(3-Bromo-phenyl)-oxazole, MFCD05668970, AC1MDTNY, 5-(3-Brom-phenyl)-oxazole, MLS000763474, SCHEMBL4755701, CHEMBL1424037, CTK4F3443, DTXSID60383785, GUYZQMXSOVOSIC-UHFFFAOYSA-N, HMS2721E19, KS-00000DL8, ZINC4277362, ANW-57539, SBB054218, AKOS015913213, MCULE-8659682013, QC-8032, TRA0005905, AJ-50105, CJ-11816, SC-26952, SMR000336819, SY003506, AB0051789, DB-004669, RT-010062, FT-0652198, ST50949805, V4628, 5-(3-Bromophenyl)-1,3-oxazole, AldrichCPR, K-6531, MFCD05668970 (97+%), 9X-0851, A817242, I14-4618, C9H6BrNO, 2-(3-BROMO-PHENYL)-OXAZOLE, ZINC04277362, CID2795565,

Complexity	154
Compound Is Canonicalized	Yes
Covalently-Bonded Unit Count	1
Defined Atom Stereocenter Count	0
Defined Bond Stereocenter Count	0
Exact Mass	222.963g/mol
Formal Charge	0
Heavy Atom Count	12
Hydrogen Bond Acceptor Count	2
Hydrogen Bond Donor Count	0
Isotope Atom Count	0
Molecular Weight	224.057g/mol
Monoisotopic Mass	222.963g/mol
Rotatable Bond Count	1
Topological Polar Surface Area	26A^2
Undefined Atom Stereocenter Count	0
Undefined Bond Stereocenter Count	0
XLogP3	2.7

GHS Hazard and Precautionary Statements

Symbol:
Hazard Class	6.1
Hazard statements	H301
Packing Group	Ⅲ
Precautionary statements	P301+P310
UN Code	UN 2811

Certificate of Analysis

Lot Number