AG003HN8

50741-92-9 | 1-Methoxy-2-methyl-4-nitrobenzene

AG003HN8

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CAS Number	50741-92-9
Catalog Number	AG003HN8(AGN-PC-0JU8LG)
Chemical Name	1-Methoxy-2-methyl-4-nitrobenzene
EC Number	256-748-5
IUPAC Name	1-methoxy-2-methyl-4-nitrobenzene
InChI	InChI=1S/C8H9NO3/c1-6-5-7(9(10)11)3-4-8(6)12-2/h3-5H,1-2H3
InChI Key	QOZMIJZYJZQOBV-UHFFFAOYSA-N
MDL Number	MFCD07787583
Molecular Formula	C8H9NO3
Molecular Weight	167.1620
SMILES	COC1=C(C)C=C(C=C1)[N+]([O-])=O
Synonyms	2-Methyl-4-nitroanisole, 1-methoxy-2-methyl-4-nitrobenzene, 50741-92-9, 1-Methoxy-2-methyl-4-nitro-benzene, 3-Methyl-4-methoxynitrobenzene, benzene, 1-methoxy-2-methyl-4-nitro-, 4-Methoxy-3-methylnitrobenzene, EINECS 256-748-5, ACMC-209kpt, AC1LD7EV, 2-Methoxy-5-nitrotoluene, 2-methyl-4-nitro-anisole, KSC275E1F, SCHEMBL187136, 2-Methyl-4-nitroanisole, 97%, CTK1H5212, KS-00000ENN, DTXSID70198786, QOZMIJZYJZQOBV-UHFFFAOYSA-N, 1-methoxy-2-methyl-4-nitrobezene, 2-METHOXY-5-NITRO TOLUENE, ZINC5018780, ANW-31119, CL8595, MFCD07787583, 5-methoxy-4-methyl-2-nitrobenzenamine, AKOS015851905, 2-METHYL-4-NITROANISOLE 97, AC-7194, AM84120, AN-9273, AS05503, CM11789, LS10772, TRA0076216, VZ34725, AJ-52956, AK-79406, CJ-12399, DS-17656, R940, SC-27688, SY004821, AB0018410, AB1008104, DB-011071, RT-002541, ST2415378, FT-0672000, 10.14272/QOZMIJZYJZQOBV-UHFFFAOYSA-N, A23222, B-8179, MFCD07787583 (97+%), A841826, AN-584/43492793, doi:10.14272/QOZMIJZYJZQOBV-UHFFFAOYSA-N, I01-4441, InChI=1/C8H9NO3/c1-6-5-7(9(10)11)3-4-8(6)12-2/h3-5H,1-2H, null, C8H9NO3, 5-Methoxy-2-nitro-p-toluidine, C8-H9-N-O3, CID643520, A10337, 99-53-6, 86771-76-8,

Complexity	166
Compound Is Canonicalized	Yes
Covalently-Bonded Unit Count	1
Defined Atom Stereocenter Count	0
Defined Bond Stereocenter Count	0
Exact Mass	167.058g/mol
Formal Charge	0
Heavy Atom Count	12
Hydrogen Bond Acceptor Count	3
Hydrogen Bond Donor Count	0
Isotope Atom Count	0
Molecular Weight	167.164g/mol
Monoisotopic Mass	167.058g/mol
Rotatable Bond Count	1
Topological Polar Surface Area	55A^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-H319
Packing Group
Precautionary statements	P305+P351+P338
UN Code

Certificate of Analysis

Lot Number