16507-02-1

Basic information

• Product Name: METHYL 4-METHYL-4-NITROPENTANOATE
• Synonyms: 4-NITRO-4-METHYLPENTANOIC ACID METHYL ESTER;METHYL 4-METHYL-4-NITROPENTANOATE;4-Methyl-4-nitropentanoic acid methyl ester;pentanoic acid, 4-methyl-4-nitro-, methyl ester;Methyl 4-nitro-4-valerate;Nsc63913;Valeric acid, 4-methyl-4-nitro-, methyl ester;Methyl 4-methyl-4-nitropentanoate ,98%
• CAS NO: 16507-02-1
• Molecular Formula: C₇H₁₃NO₄
• Molecular Weight: 175.18
• Product Categories: C6 to C7;Carbonyl Compounds;Esters;Building Blocks;C6 to C7;Carbonyl Compounds;Chemical Synthesis;Organic Building Blocks
• Mol File: 16507-02-1.mol
• Article Data: 23

Chemical Properties

• Boiling Point: 79 °C1 mm Hg(lit.)
• Flash Point: >230 °F
• Appearance: /
• Density: 1.114 g/mL at 25 °C(lit.)
• Vapor Pressure: 0.0298mmHg at 25°C
• Refractive Index: n20/D 1.441(lit.)
• CAS DataBase Reference: METHYL 4-METHYL-4-NITROPENTANOATE(CAS DataBase Reference)
• NIST Chemistry Reference: METHYL 4-METHYL-4-NITROPENTANOATE(16507-02-1)
• EPA Substance Registry System: METHYL 4-METHYL-4-NITROPENTANOATE(16507-02-1)

Safety Data

• Hazard Codes: Xi
• Statements: 36/37/38
• Safety Statements: 26-37/39
• WGK Germany: 3
• HazardClass: IRRITANT
• Hazardous Substances Data: 16507-02-1(Hazardous Substances Data)

Usage

General Description

Methyl 4-methyl-4-nitropentanoate is a chemical compound with the molecular formula C8H15NO4. It is a yellow, crystalline solid that is commonly used as a flavoring agent in the food industry. It has a fruity, floral odor and is often used in confectionery, beverages, and perfume products. Methyl 4-methyl-4-nitropentanoate is also used as an intermediate in the synthesis of pharmaceuticals and agrochemicals. It is important to handle this chemical with care as it is toxic if ingested and can cause skin and eye irritation.

InChI:InChI=1/C7H13NO4/c1-7(2,8(10)11)5-4-6(9)12-3/h4-5H2,1-3H3

Upstream product

• 79-46-9 2-nitropropane 
• 292638-85-8 acrylic acid methyl ester 
• 92574-32-8 4-Nitro-4-(4-nitro-phenyl)-pentanoic acid methyl ester 
• 100-52-7 benzaldehyde 
• 4749-28-4 2-nitropropene 
• 3395-91-3 Methyl 3-bromopropionate 

Downstream Products

• 5165-28-6 5,5-dimethyl-2-pyrrolidone 
• 85054-53-1 4-amino-4-methyl-pentan-1-ol 
• 5215-92-9 4-methyl-4-nitro-1-pentanol 
• 32827-16-0 4-methyl-4-nitropentanoic acid 
• 3235-46-9 NSC 20667 
• 1455092-71-3 methyl 4-(1-cyano-4-hydroxy-7-phenoxyisoquinoline-3-carboxamido)-4-methylpentanoate 
• 1198222-55-7 N-(5-((2,4-dioxo-3,4-dihydropyrimidin-1(2H)-yl)methoxy)-2-methylpentan-2-yl)-3-methoxybenzenesulfonamide 
• 1198222-64-8 N-(5-((2,4-dioxo-3,4-dihydropyrimidin-1(2H)-yl)methoxy)-2-methylpentan-2-yl)-2-methoxy-4-methylbenzenesulfonamide 
• 1198222-79-5 N-(5-((2,4-dioxo-3,4-dihydropyrimidin-1(2H)-yl)methoxy)-2-methylpentan-2-yl)benzenesulfonamide 
• 107954-48-3 2,3-dihydro-1,1-dimethyl-3-(phenylmethylene)pyrrolo<2,1-b>quinazoline-9(1H)-one 

Relevant articles and documents

Syntheses and spin trappings of 3-hydroxymethyl-5,5-dimethyl-1-pyrroline N-oxide and 3-(3-hydroxypropyl)-5,5-dimethyl-1-pyrroline N-oxide

New nitrones of 5,5-dimethyl-1-pyrroline N-oxide (DMPO)-type , 3-hydroxymethyl-5,5-dimethyl-1-pyrroline N-oxide (3HM-DMPO) and 3-(3-hydroxypropyl)-5,5-dimethyl-1-pyrroline N-oxide (3HP-DMPO), were synthesized and tested for the ability in radical trapping of oxygen-centered radicals. 3HM-DMPO trapped superoxide but did not hydroxyl radicals, whereas 3HP-DMPO served as a trap for both radicals.

LOW TOXICITY NMP SUBSTITUTES AND USES THEREOF

The present technology is directed to compounds Formulas I, II, III, and IV as well as compositions that include one or more of the compounds and methods of making the compounds. In particular, the present compounds may be used as a replacement for NMP in compositions to produce lower toxicity compositions.

CDK4/6 INHIBITORS AND USE THEREOF

The present disclosure relates to a compound of formula (I), or a pharmaceutically acceptable salt, a solvate, a stereoisomer, or tautomer thereof, a pharmaceutical composition comprising a compound of formula (A) or formula (B), and any subgenera thereof, and use of said compounds and compositions thereof, wherein R1, R2, R3a, R3b, R5, R6, X1, X2, Y and n are described herein.