AG001ZZR

17484-36-5 | Benzene, 4-methoxy-1-methyl-2-nitro-

AG001ZZR

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CAS Number	17484-36-5
Catalog Number	AG001ZZR(AGN-PC-0JLWLK)
Chemical Name	Benzene, 4-methoxy-1-methyl-2-nitro-
EC Number	241-500-0
IUPAC Name	4-methoxy-1-methyl-2-nitrobenzene
InChI	InChI=1S/C8H9NO3/c1-6-3-4-7(12-2)5-8(6)9(10)11/h3-5H,1-2H3
InChI Key	JBORNNNGTJSTLC-UHFFFAOYSA-N
MDL Number	MFCD00007173
Molecular Formula	C8H9NO3
Molecular Weight	167.1620
SMILES	C1=C(OC)C=CC(=C1[N+]([O-])=O)C
Synonyms	4-Methyl-3-nitroanisole, 17484-36-5, 4-Methoxy-2-nitrotoluene, 4-Methoxy-1-methyl-2-nitrobenzene, 2-Nitro-4-methoxytoluene, 3-Nitro-4-methylanisole, Benzene, 4-methoxy-1-methyl-2-nitro-, 4-METHOXY-1-METHYL-2-NITRO-BENZENE, Anisole, 4-methyl-3-nitro-, JBORNNNGTJSTLC-UHFFFAOYSA-N, TIMTEC-BB SBB008488, EINECS 241-500-0, zlchem 436, PubChem3127, ACMC-209ysk, 2-Nitro-4-methoxytoluol, 4-methyl-3-nitro-anisole, Intermediates-ZCF02300, AC1L3D0X, KSC494O5H, SCHEMBL178068, Jsp003583, 4-Methyl-3-nitroanisole, 99%, CTK3J4753, KS-00000MKJ, DTXSID80169907, ZLC0294, 1-methoxy-4-methyl-3-nitrobenzene, ACN-S004442, ACT00999, ZINC2567949, ANW-49362, MFCD00007173, SBB008488, 4-Methoxy-1-methyl-2-nitrobenzene #, AKOS015842372, AC-9004, AN-7445, AS02095, AS04181, CM-1023, CM11788, CS-W002024, DS-0836, FR-2165, MCULE-9791813886, PS-3420, RP22986, RTR-007780, VZ29379, 1-methyl-4-(methyloxy)-2-nitrobenzene, TRA-0206723, AJ-41521, AK-33706, BR-33706, CJ-09821, SC-01732, SY004307, U432, AB0019262, AB1008109, DB-043994, ST2411531, TL8001387, TR-007780, AM20050063, FT-0619032, ST50406610, MFCD00007173 (98%), A19674, M-2878, 484M365, I01-2541, W-107849, InChI=1/C8H9NO3/c1-6-3-4-7(12-2)5-8(6)9(10)11/h3-5H,1-2H, C8H9NO3, C8-H9-N-O3, CID87137, ZINC02567949, 4-Methyl-3-nitroanisole, 98% - 1G 1g,

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	2.4

GHS Hazard and Precautionary Statements

Symbol:
Hazard Class
Hazard statements	H302
Packing Group
Precautionary statements	P280-P305+P351+P338
Signal Words	warning
UN Code

Certificate of Analysis

Lot Number