N-Methylnicotinamide

Base Information

Chemical Name:N-Methylnicotinamide
CAS No.:114-33-0
Molecular Formula:C7H8N2O
Molecular Weight:136.153
Hs Code.:2933399090
European Community (EC) Number:204-046-4
NSC Number:66521
UNII:X3I82S5L8I
DSSTox Substance ID:DTXSID00870467
Nikkaji Number:J60.113F
Wikipedia:Nicotinyl_methylamide
Wikidata:Q744041
Metabolomics Workbench ID:38259
ChEMBL ID:CHEMBL11978
Mol file:114-33-0.mol

Synonyms:N-METHYL-NICOTINAMIDE;N-methylnicotinamide;N-methylnicotinamide monohydrochloride

Suppliers and Price of N-Methylnicotinamide

Supply Marketing:

Business phase:: The product has achieved commercial mass production^*data from LookChem market partment

Manufacturers and distributors:

Manufacture/Brand
Chemicals and raw materials
Packaging
price

TRC
N-Methylnicotinamide
5g
$ 130.00

TCI Chemical
N-Methylnicotinamide >98.0%(GC)(T)
10g
$ 73.00

TCI Chemical
N-Methylnicotinamide >98.0%(GC)(T)
25g
$ 124.00

Medical Isotopes, Inc.
N-Methylnicotinamide-d4
10 mg
$ 490.00

Crysdot
N-Methylnicotinamide 95+%
25g
$ 105.00

Crysdot
N-Methylnicotinamide 95+%
5g
$ 50.00

Crysdot
N-Methylnicotinamide 95+%
100g
$ 315.00

ChemScene
N-Methylnicotinamide 99.63%
100g
$ 315.00

ChemScene
N-Methylnicotinamide 99.63%
10g
$ 60.00

ChemScene
N-Methylnicotinamide 99.63%
25g
$ 105.00

Total 53 raw suppliers

Chemical Property of N-Methylnicotinamide

Chemical Property:

Appearance/Colour:white to light yellow-beige crystalline powder
Vapor Pressure:5.3E-05mmHg at 25°C
Melting Point:102-105 °C(lit.)
Refractive Index:1.529
Boiling Point:347.7 °C at 760 mmHg
PKA:13.97±0.46(Predicted)
Flash Point:164.1 °C
PSA：41.99000
Density:1.106 g/cm³
LogP:0.83210
Storage Temp.:Inert atmosphere,Room Temperature
Solubility.:Chloroform (Slightly), Methanol (Slightly)
XLogP3:0
Hydrogen Bond Donor Count:1
Hydrogen Bond Acceptor Count:2
Rotatable Bond Count:1
Exact Mass:136.063662883
Heavy Atom Count:10
Complexity:125

Purity/Quality:

97% ^*data from raw suppliers

N-Methylnicotinamide ^*data from reagent suppliers

Safty Information:

Pictogram(s): Xi
Hazard Codes:Xi
Statements: 36/37/38
Safety Statements: 26-36

MSDS Files:: SDS file from LookChem

Useful:

Canonical SMILES:CNC(=O)C1=CN=CC=C1
Uses N-Methylnicotinamide is a metabolite of Nicotinamide (N407750), which is a water-soluble vitamin B, incorporated within nicotinamide cofactors such as NADH and NADPH. N-Methylnicotinamide is commonly found in the human urine and is used as a biomarker to study diseases such as liver cirrhosis and type 2 diabetes.

Technology Process of N-Methylnicotinamide

There total 12 articles about N-Methylnicotinamide which guide to synthetic route it. The literature collected by LookChem mainly comes from the sharing of users and the free literature resources found by Internet computing technology. We keep the original model of the professional version of literature to make it easier and faster for users to retrieve and use. At the same time, we analyze and calculate the most feasible synthesis route with the highest yield for your reference as below:

synthetic route:

Reference yield: 90.0%

: 614-18-6
3-pyridinecarboxylic acid ethyl ester

: 84738-96-5
C₂H₇AlClN

: 114-33-0
N-Methylnicotinamide

Guidance literature:: In benzene; for 12h; Heating;

Reference yield: 87.0%

: 67-56-1
methanol

: 98-92-0,1255150-40-3
nicotinamide

: 114-33-0
N-Methylnicotinamide

Guidance literature:: With C₅₄H₄₃ClN₃P₂Ru⁽¹⁺⁾*F₆P^(1-); caesium carbonate; In toluene; at 140 ℃; for 48h; Inert atmosphere; Sealed tube; Green chemistry;
DOI:10.1021/acs.orglett.9b01925