Methyl 5-nitroisophthalate

Methyl 5-nitroisophthalate Basic information

Product Name:	Methyl 5-nitroisophthalate
Synonyms:	NITROISOPHTHALIC-5 ACID, MONOMETHYL ESTER;MONO-METHYL 5-NITROISOPHTHALATE;MONO-METHYL-5-NITROISOPHTHALIC ACID;3-benzenedicarboxylicacid,5-nitro-monomethylester;5-Nirto-iso-phthalicacidmonomethylester;METHYL HYDROGEN 5-NITROISOPHTHALATE;Methyl 5-nitroisophthalate;LABOTEST-BB LT00848268
CAS:	1955-46-0
MF:	C9H7NO6
MW:	225.15
EINECS:	217-793-6
Product Categories:	Phthalic Acids, Esters and Derivatives
Mol File:	1955-46-0.mol

Methyl 5-nitroisophthalate Chemical Properties

Melting point	180-182 °C (lit.)
Boiling point	366.65°C (rough estimate)
density	1.5322 (rough estimate)
vapor pressure	0-0Pa at 25℃
refractive index	1.5200 (estimate)
storage temp.	Sealed in dry,Room Temperature
solubility	9g/L in organic solvents at 20 ℃
pka	3.11±0.10(Predicted)
form	Fine Crystalline Powder
color	Slightly yellow
Water Solubility	insoluble
BRN	1469253
LogP	1.65 at 25℃
CAS DataBase Reference	1955-46-0(CAS DataBase Reference)
EPA Substance Registry System	Monomethyl 5-nitroisophthalate (1955-46-0)

Safety Information

Hazard Codes	T+
Risk Statements	36/37/38-26/27/28
Safety Statements	22-24/25-45-36/37/39
RIDADR	UN 2811
WGK Germany	3
TSCA	Yes
HS Code	29173980

MSDS Information

Provider	Language
Methyl 5-nitroisophthalate	English
ACROS	English
SigmaAldrich	English
ALFA	English

Methyl 5-nitroisophthalate Usage And Synthesis

Chemical Properties	SLIGHTLY YELLOW FINE CRYSTALLINE POWDER
Uses	Methyl 5-nitroisophthalate is used in the preparation of heterotrifunctional crosslinkers for multiple bioconjugation with peptides and also in the synthesis of histone demethylase LSD1 inhibitors tha t target cancer cells.
Uses	mono-Methyl 5-nitroisophthalate has been used as starting reagent in the synthesis of 3-amide-5-[(dipropylamino)carbonyl]benzoic acids.
Flammability and Explosibility	Nonflammable

Methyl 5-nitroisophthalate Preparation Products And Raw materials

Raw materials	Dimethyl 5-nitroisophthalate-->Methanol-->5-Nitroisophthalic acid
Preparation Products	5-AMINO-N-METHYLISOPHTHALAMIC ACID-->5-NITRO-ISOPHTHALIC ACID MONOMETHYL AMIDE-->Desmethoxyacetyliopromid-->5-Aminoisophthalic acid monomethyl ester

5-Nitroisophthalic acid Methylparaben 3-Nitrobenzoic acid METHYL CAFFEATE Bensulfuron methyl Parathion-methyl Mono-methyl isophthalate Methyl cinnamate METHYLISOCYANATE 1 X 500MG NEAT Thiophanate-methyl BUTYL OLEATE POLY(METHYL ACRYLATE) Methyl benzoate FATTY ACID METHYL ESTER MIX C8-C22 Methyl bromide Methyl dihydrojasmonate EPA 2-Nitrobenzoic acid

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