AG003NDU

885270-14-4 | 7-Bromobenzo[d]oxazole

AG003NDU

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CAS Number	885270-14-4
Catalog Number	AG003NDU(AGN-PC-09RRUG)
Chemical Name	7-Bromobenzo[d]oxazole
IUPAC Name	7-bromo-1,3-benzoxazole
InChI	InChI=1S/C7H4BrNO/c8-5-2-1-3-6-7(5)10-4-9-6/h1-4H
InChI Key	IGYSQBXPJOGYML-UHFFFAOYSA-N
MDL Number	MFCD08234619
Molecular Formula	C7H4BrNO
Molecular Weight	198.0168
SMILES	Brc1c2c(ccc1)nco2
Synonyms	7-bromobenzo[d]oxazole, 885270-14-4, 7-bromo-1,3-benzoxazole, 7-BROMOBENZOXAZOLE, Benzoxazole, 7-bromo, 7-BROMO-BENZOOXAZOLE, 7-bromobenzooxazole, Benzoxazole,7-bromo-, AMOT0003, SCHEMBL3231956, CTK5G0139, DTXSID80696304, KS-00000EB6, ANW-71801, MFCD08234619, ZINC62522403, AKOS006284011, CB-3165, CS-W003470, FS-3724, MB05566, MP-0348, TRA0063037, AK-68227, CJ-20919, SC-44494, SY018760, AB0051843, AJ-114140, DB-050749, TC-160546, 4CH-006947, AM20041307, FT-0660720, ST24029907, Z5260, MFCD08234619 (97+%), Z1741981136, C7H4BrNO, 348080-90-0,

Complexity	131
Compound Is Canonicalized	Yes
Covalently-Bonded Unit Count	1
Defined Atom Stereocenter Count	0
Defined Bond Stereocenter Count	0
Exact Mass	196.948g/mol
Formal Charge	0
Heavy Atom Count	10
Hydrogen Bond Acceptor Count	2
Hydrogen Bond Donor Count	0
Isotope Atom Count	0
Molecular Weight	198.019g/mol
Monoisotopic Mass	196.948g/mol
Rotatable Bond Count	0
Topological Polar Surface Area	26A^2
Undefined Atom Stereocenter Count	0
Undefined Bond Stereocenter Count	0
XLogP3	2.5

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