2-Nitro-3,4,5-trimethoxybenzoic acid methyl ester

cas: 5081-42-5 — see every product listed under this CAS number, including other names

2-Nitro-3,4,5-trimethoxybenzoic acid methyl ester (CAS 5081-42-5) is a chemical reagent available from Chemat. Available pack sizes: 250g, 500g. Offered by: Biosynth.

brandBiosynth
catalog numberFN54878-250g
cas5081-42-5
size250g
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properties

categoryResearch Chemicals
purityNo data
delivery time1-2 weeks
Structural formula: {0} (CAS {1})

Methyl 3,4,5-trimethoxy-2-nitrobenzoate (CAS 5081-42-5) is a chemical compound with the molecular formula C11H13NO7 and a molecular weight of 271.22 g/mol. IUPAC name: methyl 3,4,5-trimethoxy-2-nitrobenzoate. InChIKey: HCEIEWYPDCDNNU-UHFFFAOYSA-N.

Identity
Molecular formulaC11H13NO7
Molecular weight271.22 g/mol
IUPAC namemethyl 3,4,5-trimethoxy-2-nitrobenzoate
InChIKeyHCEIEWYPDCDNNU-UHFFFAOYSA-N
SMILESCOC1=C(C(=C(C(=C1)C(=O)OC)[N+](=O)[O-])OC)OC

Computed by PubChem (NCBI)

Synonyms: Methyl 3,4,5-trimethoxy-2-nitrobenzoate, Methyl 2-nitro-3,4,5-trimethoxybenzoate, Benzoic acid, 3,4,5-trimethoxy-2-nitro-, methyl ester, 2-Nitro-3,4,5-trimethoxybenzoic acid methyl ester, HCEIEWYPDCDNNU-UHFFFAOYSA-, HCEIEWYPDCDNNU-UHFFFAOYSA-N, InChI=1/C11H13NO7/c1-16-7-5-6(11(13)19-4)8(12(14)15)10(18-3)9(7)17-2/h5H,1-4H3, Methyl 6-nitro-3,4,5-trimethoxybenzoate, 3,4,5-Trimethoxy-2-nitrobenzoic acid methyl ester, Opera_ID_1985
Isomers (same molecular formula)
(2S,3R,4S,5S)-2-(4-nitrophenoxy)oxane-3,4,5-triol C11H13NO7
(2S,3R,4S,5R)-2-(2-nitrophenoxy)oxane-3,4,5-triol C11H13NO7
(2R,3R,4S,5R)-2-(4-nitrophenoxy)oxane-3,4,5-triol C11H13NO7
(2S,3R,4R,5S)-2-(hydroxymethyl)-5-(4-nitrophenoxy)oxolane-3,4-diol C11H13NO7
(2S,3R,4S,5R)-2-(4-nitrophenoxy)oxane-3,4,5-triol C11H13NO7
(2R,3R,4S,5S)-2-(4-nitrophenoxy)oxane-3,4,5-triol C11H13NO7
(2R,3S,4R,5S)-2-(hydroxymethyl)-5-(4-nitrophenoxy)oxolane-3,4-diol C11H13NO7
[(3aR,4R,6aS)-2,3,3a,4,5,6a-hexahydrofuro[2,3-b]furan-4-yl] (2,5-dioxopyrrolidin-1-yl) carbonate C11H13NO7
[(3aR,4S,6aS)-2,3,3a,4,5,6a-hexahydrofuro[2,3-b]furan-4-yl] (2,5-dioxopyrrolidin-1-yl) carbonate C11H13NO7
[(3aS,4S,6aR)-2,3,3a,4,5,6a-hexahydrofuro[2,3-b]furan-4-yl] (2,5-dioxopyrrolidin-1-yl) carbonate C11H13NO7
[(3aS,4R,6aR)-2,3,3a,4,5,6a-hexahydrofuro[2,3-b]furan-4-yl] (2,5-dioxopyrrolidin-1-yl) carbonate C11H13NO7

Also listed as

Methyl 2-nitro-3,4,5-trimethoxybenzoate, 98% Combi-blocks CAS 5081-42-5
Methyl 2–nitro–3，4，5–trimethoxybenzoate GLPBio CAS 5081-42-5
Methyl 2-nitro-3,4,5-trimethoxybenzoate, 95%, 95% Chemat CAS 5081-42-5