AG003RSZ

24078-21-5 | Methyl 3-methyl-4-nitrobenzoate

AG003RSZ

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CAS Number	24078-21-5
Catalog Number	AG003RSZ(AGN-PC-0JNWB3)
Chemical Name	Methyl 3-methyl-4-nitrobenzoate
EC Number	607-315-8
IUPAC Name	methyl 3-methyl-4-nitrobenzoate
InChI	InChI=1S/C9H9NO4/c1-6-5-7(9(11)14-2)3-4-8(6)10(12)13/h3-5H,1-2H3
InChI Key	IEFONJKJLZFGKQ-UHFFFAOYSA-N
MDL Number	MFCD00085640
Molecular Formula	C9H9NO4
Molecular Weight	195.1721
NSC Number	92763
SMILES	CC=1C=C(C(=O)OC)C=CC1[N+](=O)[O-]
Synonyms	Methyl 3-methyl-4-nitrobenzoate, 24078-21-5, 3-Methyl-4-nitrobenzoic Acid Methyl Ester, Benzoic acid, 3-methyl-4-nitro-, methyl ester, 24078-71-5, IEFONJKJLZFGKQ-UHFFFAOYSA-N, MFCD00085640, m-Toluic acid, 4-nitro-, methyl ester, Methyl 3-methyl-4-nitrobenzenecarboxylate, Benzoic acid, 3-methyl-4-nitro, methyl ester, NSC92763, METHYL3-METHYL-4-NITROBENZOATE, PubChem2350, ACMC-1CFDU, AC1Q5ASM, Methyl 4-Nitro-m-toluate, KSC205M3D, AC1L646D, BEN146, SCHEMBL1890677, Jsp004808, methyl-3-methyl-4-nitrobenzoate, CTK1A5631, methyl 3-methyl-4-nitro-benzoate, 4-Nitro-m-toluic acid methylester, ZINC153316, ACT00840, ALBB-020404, BCP24522, CS-M0758, Methyl 3-methyl-4-nitrobenzoate #, 4-Nitro-m-toluic Acid Methyl Ester, ANW-25318, NSC-92763, SBB053758, AKOS003382085, AC-5780, MCULE-6089762533, RP04000, RTC-064118, TRA0169742, VZ32611, KS-0000051H, METHYL 4-NITRO-3-METHYLBENZOATE, AJ-12942, AK-45806, AN-10643, BR-45806, CJ-01248, SC-02791, SY006108, ZB005401, 3-methyl4-nitro-benzoic acid methyl ester, 3-methyl-4-nitro-benzoic acid methyl ester, AB0008446, ST2413370, TC-064118, TL8001986, AM20061238, FT-0628571, FT-0680041, M2145, ST45026646, MFCD00085640 (98%), M-2325, 11X-0801, S01-0152, W-206871, I01-13659, Phosphonicacid,p-[[(isocyanatosulfonyl)amino]carbonyl]-,dimethyl ester, C9H9NO4, 2-Amino-5,6-dichlorobenzothiazole, AR-1J5177, CID260927, Benzoic acid, 3-methyl-4-nitro-methyl ester, 24220-17-5,

Complexity	236
Compound Is Canonicalized	Yes
Covalently-Bonded Unit Count	1
Defined Atom Stereocenter Count	0
Defined Bond Stereocenter Count	0
Exact Mass	195.053g/mol
Formal Charge	0
Heavy Atom Count	14
Hydrogen Bond Acceptor Count	4
Hydrogen Bond Donor Count	0
Isotope Atom Count	0
Molecular Weight	195.174g/mol
Monoisotopic Mass	195.053g/mol
Rotatable Bond Count	2
Topological Polar Surface Area	72.1A^2
Undefined Atom Stereocenter Count	0
Undefined Bond Stereocenter Count	0
XLogP3	2.7

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