Methyl 6-methylnicotinate
-
Methyl 6-methylnicotinate
structure -
-
CAS No:
5470-70-2
-
Formula:
C8H9NO2
-
Chemical Name:
Methyl 6-methylnicotinate
-
Synonyms:
3-Pyridinecarboxylic acid,6-methyl-,methyl ester;Nicotinic acid,6-methyl-,methyl ester;Methyl 6-methylnicotinate;Methyl 6-methyl-3-pyridinecarboxylate;6-Methylnicotinic acid methyl ester;3-(Methoxycarbonyl)-6-methylpyridine;5-Methoxycarbonyl-2-methylpyridine;Methyl 6-methylaminonicotinate;6-Methyl-3-pyridinecarboxylic acid methyl ester;NSC 27973
- Categories:
-
CAS No:
Methyl 6-methylnicotinate Basic Attributes
151.16
151.16
122940
1308068-626-2
YA0K0CM5PK
27973
DTXSID80282781
2933399090
Characteristics
39.2
1.2
Clear colorless to slightly yellow Liquid
1.1±0.1 g/cm3
32 °C
106-108 °C @ Press: 18 Torr
218 °F
1.510
Refrigerator
Safety Information
NONH for all modes of transport
3
36/37/38
26
Xi
Irritant
N/A
P261-P305 + P351 + P338
H315-H319-H335
|Warning|H315 (100%): Causes skin irritation [Warning Skin corrosion/irritation]|P261, P264, P271, P280, P302+P352, P304+P340, P305+P351+P338, P312, P321, P332+P313, P337+P313, P362, P403+P233, P405, and P501|Aggregated GHS information provided by 54 companies from 9 notifications to the ECHA C&L Inventory. Each notification may be associated with multiple companies.
Methyl 6-methylnicotinate Use and Manufacturing
To a stirred solution of compound I (40 g; 290 mmol; 1 eq) in methanol (0.75 L) was added sulfuric acid (40 mL) and the resulting mixture was heated at reflux for 17 h. The mixture was then evaporated to dryness and the pH was adjusted to 7 using saturated ice-cold aqueous NaHCO3 solution and solid NaHCO3. The organic components were extracted from the aqueous layer with ethyl acetate (3 x 500 mL) and the combined organic layers were washed with brine, dried over anhydrous sodium sulfate, filtered and the solvent was removed in vacuo to afford the title compound (33 g, 75percent) as an off-white solid. 1H NMR (CDC13) ö 9.06 (s, 1H), 8.13 (dd, 1H, J = 2, 8 Hz), 7.20 (d, 1H, J = 8 Hz), 3.89 (s, 3H), 2.58 (s, 3H). LCMS: m/z = 152.4 [M+Hj , RT = 2.36 minutes, (Program P1, Column W).
It is used in the treatment of CNS disorders using D-amino acid oxidase and D-aspartate oxidase inhibitors.
Computed Properties
Molecular Weight:151.16
XLogP3:1.2
Hydrogen Bond Acceptor Count:3
Rotatable Bond Count:2
Exact Mass:151.063328530
Monoisotopic Mass:151.063328530
Topological Polar Surface Area:39.2
Heavy Atom Count:11
Complexity:147
Covalently-Bonded Unit Count:1
Compound Is Canonicalized:Yes
Recommended Suppliers of Methyl 6-methylnicotinate
-
![China]()
CN
5 YRS
Business licensed Certified factoryManufactory Supplier of Agrochemicals,Daily Chemicals,Catalysts & Chemical Auxiliary Agents,Extract,Inorganic Chemicals,Organic Intermediate,Pigment & Dyestuff,Polymer,Flavour & Fragrance,Basic Organic Chemicals,Pharmaceutical -
![China]()
CN
5 YRS
Business licensedTrader Supplier of Intermediates,Building blocks,API,Silicones,Peptides,Lab chemicals,Biochemicals,Pharmaceuticals,Screening Compounds,Food Additives -
![China]()
CN
3 YRS
Business licensedTrader Supplier of api,Intermediates,Organic Chemistry,Inorganic Chemistry,Daily Chemicals,Cosmetic Raw Materals,CATALYST AND AUXILIARY,FLAVORS AND FRAGRANCES,Chemical Pesticides,ADDITIVEInquiryCAS No.: 5470-70-2Grade: Analytical ReagentContent: 99% -
![China]()
CN
4 YRS
Business licensed Certified factoryManufactory Supplier of intermediatesInquiryCAS No.: 5470-70-2Grade: Pharmaceutical GradeContent: 98% -
![China]()
CN
5 YRS
Business licensedTrader Supplier of PVC resin,pvc paste resin,melamineInquiryCAS No.: 5470-70-2Grade: Industrial GradeContent: 99%
Learn More Other Chemicals
-
2-Cyclobutene-1-carboxylic acid, 4-(chlorocarbonyl)-, methyl ester, cis- (9CI)
139591-41-6
-
Cyclopentanecarboxylic acid, 2-(hydroxyimino)-, methyl ester (9CI)
170016-09-8
-
Cyclopentanecarboxylic acid, 2-hydroxy-, methyl ester, (1R,2R)- (9CI)
124150-22-7
-
Cyclopenta[b]pyrrole-2-carboxylic acid, octahydro-, methyl ester, [2R-(2-alpha-,3a-ba-,6a-ba-)]- (9CI) Formula
156557-90-3
-
Cyclohexanecarboxylic acid, 2-(acetylamino)-, methyl ester, cis- (9CI) Formula
193635-12-0
-
D-arabino-Pentodialdo-5,2-furanoside, methyl 3,4-O-(1-methylethylidene)- (9CI) Formula
821792-69-2
-
Cysteine, 2-methyl-, methyl ester (9CI) Structure
778548-47-3
-
Cyclopropanecarboxylic acid, 2-(1-methylethenyl)-, methyl ester, trans-(-)- Structure
52148-73-9
-
What is D-Glucuronal 3,4-Diacetate Methyl Ester
34296-99-6
-
What is 4-(4,5-di[1,1'-biphenyl]-4-yl-1H-imidazol-2-yl)phenyl methyl sulfide
312320-17-5