AG006FR2

92629-11-3 | 5-bromo-2-phenyl-1,3-oxazole

AG006FR2

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CAS Number	92629-11-3
Catalog Number	AG006FR2(AGN-PC-0KKVBA)
Chemical Name	5-bromo-2-phenyl-1,3-oxazole
IUPAC Name	5-bromo-2-phenyl-1,3-oxazole
InChI	InChI=1S/C9H6BrNO/c10-8-6-11-9(12-8)7-4-2-1-3-5-7/h1-6H
InChI Key	MSXVETKZQOUBNB-UHFFFAOYSA-N
MDL Number	MFCD00466256
Molecular Formula	C9H6BrNO
Molecular Weight	224.0540
SMILES	BrC1=CN=C(O1)C1=CC=CC=C1
Synonyms	5-bromo-2-phenyloxazole, 92629-11-3, 5-bromo-2-phenyl-1,3-oxazole, Oxazole, 5-bromo-2-phenyl-, AK-40252, Q-103466, AC1MCMPC, 2-Phenyl-5-bromooxazole, 5-bromo-2-phenyl-Oxazole, SCHEMBL84546, CTK5H1533, DTXSID30378325, MSXVETKZQOUBNB-UHFFFAOYSA-N, BCP23313, KS-00000F2M, OXAZOLE,5-BROMO-2-PHENYL-, ZINC2565743, ANW-59270, CB0136, MFCD00466256, AKOS015835700, FCH1322038, RL05833, AJ-41169, AS-19746, SY104153, AB1010315, AX8102830, DB-079367, TX-011421, FT-0732233, ST24044455, Y6510, MFCD00466256 (95%), I14-13004, C9H6BrNO, 2-bromoimidazo[1,2-a]pyridine, ACN-039319, CID2773271,

Complexity	148
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	3

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

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