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经验公式(希尔记法):
C7H7NO2
化学文摘社编号:
分子量:
137.14
UNSPSC Code:
12352100
NACRES:
NA.22
PubChem Substance ID:
EC Number:
202-261-8
Beilstein/REAXYS Number:
113951
MDL number:
InChI key
YNBADRVTZLEFNH-UHFFFAOYSA-N
InChI
1S/C7H7NO2/c1-10-7(9)6-3-2-4-8-5-6/h2-5H,1H3
SMILES string
COC(=O)c1cccnc1
biological source
synthetic
grade
puriss.
assay
≥99.0% (GC)
form
powder or crystals (possibly with chunks)
color
white to faint yellow
bp
204 °C (lit.)
mp
39-42 °C, 42-44 °C (lit.)
solubility
H2O: 0.1 g/mL, clear
functional group
ester
Quality Level
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General description
Methyl nicotinate (or nicotinic acid methyl ester) is used as a rubefacient for the relief of pains in muscles, tendons, and joints. It is also used in food as a flavoring agent.
Application
Methyl nicotinate can be used as a precursor:
- In the asymmetric synthesis of 1-azasugars (glycosidase inhibitors) for biomedical applications.
- In the total synthesis of ±-sesbanine.
signalword
Warning
hcodes
Hazard Classifications
Eye Irrit. 2 - Skin Irrit. 2 - STOT SE 3
target_organs
Respiratory system
存储类别
11 - Combustible Solids
wgk
WGK 3
ppe
dust mask type N95 (US), Eyeshields, Gloves
法规信息
新产品
此项目有
Topical antirheumatic agents as hydroxyl radical scavengers
Billany MR, et al.
International Journal of Pharmaceutics, 124(2), 279-283 (1995)
A facile synthesis of ? -sesbanine via γ-addition of ketene silyl acetal with quaternized methyl nicotinate
Wada M, et al.
Tetrahedron Letters, 26(27), 3267-3270 (1985)
Selective fowler reductions: asymmetric total syntheses of isofagomine and other 1-azasugars from methyl nicotinate
Zhao G, et al.
Organic Letters, 3(2), 201-203 (2001)
Melissa Kerr et al.
Prostaglandins, leukotrienes, and essential fatty acids, 79(1-2), 15-19 (2008-07-29)
Topical application of nicotinic acid results in erythema, and in some cases oedema of the skin, supporting a strong relationship between niacin sensitivity and prostaglandin D2. The aim of this study was to examine the inter-rater and intra-rater reliability of
Henriette Baun Madsen et al.
The AAPS journal, 11(4), 728-739 (2009-10-29)
This study aimed to investigate the effect of a novel kind of immune-stimulating complexes (ISCOMs) on human skin penetration of model compounds in vitro to evaluate their potential as a delivery system, ultimately for transcutaneous vaccination. Special focus was on
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