AG00BDQ4

20304-86-3 | 5-Methylbenzofurazan

AG00BDQ4

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CAS Number	20304-86-3
Catalog Number	AG00BDQ4(AGN-PC-0JS92P)
Chemical Name	5-Methylbenzofurazan
IUPAC Name	5-methyl-2,1,3-benzoxadiazole
InChI	InChI=1S/C7H6N2O/c1-5-2-3-6-7(4-5)9-10-8-6/h2-4H,1H3
InChI Key	RRZFDFYIDRCBCQ-UHFFFAOYSA-N
MDL Number	MFCD00068073
Molecular Formula	C7H6N2O
Molecular Weight	134.1353
SMILES	CC1=CC2C(=NON=2)C=C1
Synonyms	5-Methylbenzofurazan, 20304-86-3, 5-Methyl-2,1,3-benzoxadiazole, 5-methylbenzo[c][1,2,5]oxadiazole, 2,1,3-Benzoxadiazole, 5-methyl-, PubChem14814, AC1LAT15, KSC543Q5P, SCHEMBL961193, AMBZ0248, CTK4E3857, DTXSID00334135, RRZFDFYIDRCBCQ-UHFFFAOYSA-N, ZINC161256, 5-Methyl-2,1,3-benzoxadiazole #, 5-methylbenzo[c]1,2,5-oxadiazole, ANW-44856, MFCD00068073, SBB085860, AKOS006229783, AM85658, RP01021, AJ-15694, CJ-01959, DS-18518, ZB007514, AB0040538, DB-004812, ST2406319, TC-072247, FT-0620645, Y8159, K-5931, 304M863, A814423, I14-5802, W-206499, C7H6N2O, CID519763, ZINC00161256, 205442-89-3,

Complexity	129
Compound Is Canonicalized	Yes
Covalently-Bonded Unit Count	1
Defined Atom Stereocenter Count	0
Defined Bond Stereocenter Count	0
Exact Mass	134.048g/mol
Formal Charge	0
Heavy Atom Count	10
Hydrogen Bond Acceptor Count	3
Hydrogen Bond Donor Count	0
Isotope Atom Count	0
Molecular Weight	134.138g/mol
Monoisotopic Mass	134.048g/mol
Rotatable Bond Count	0
Topological Polar Surface Area	38.9A^2
Undefined Atom Stereocenter Count	0
Undefined Bond Stereocenter Count	0
XLogP3	1.5

GHS Hazard and Precautionary Statements

Symbol:
Hazard Class
Hazard statements	H315-H319-H335
Packing Group
Precautionary statements	P261-P305+P351+P338
UN Code

Certificate of Analysis

Lot Number