72351
Benzyl nicotinate
≥98.0% (GC)
Synonym(s):
Nicotinic acid benzyl ester
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About This Item
Empirical Formula (Hill Notation):
C13H11NO2
CAS Number:
Molecular Weight:
213.23
UNSPSC Code:
12352100
NACRES:
NA.22
PubChem Substance ID:
EC Number:
202-332-3
Beilstein/REAXYS Number:
159169
MDL number:
Assay:
≥98.0% (GC)
Form:
liquid
Quality Level
assay
≥98.0% (GC)
form
liquid
refractive index
n20/D 1.570
bp
177 °C/8 mmHg (lit.)
mp
24 °C (lit.)
functional group
ester, phenyl
SMILES string
O=C(OCc1ccccc1)c2cccnc2
InChI
1S/C13H11NO2/c15-13(12-7-4-8-14-9-12)16-10-11-5-2-1-3-6-11/h1-9H,10H2
InChI key
KVYGGMBOZFWZBQ-UHFFFAOYSA-N
General description
Benzyl nicotinate is a benzyl ester. It is a vasodilator agent and is also generally used in cosmetics and drugs.
Application
Benzyl nicotinate can be used for the synthesis of benzylpalladium complexes to be used as catalysts for the substitution of olefins with benzylic groups.
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signalword
Warning
hcodes
Hazard Classifications
Eye Irrit. 2 - Skin Irrit. 2
Storage Class
11 - Combustible Solids
wgk
WGK 2
flash_point_f
235.4 °F - closed cup
flash_point_c
113 °C - closed cup
ppe
dust mask type N95 (US), Eyeshields, Gloves
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V Erjavec et al.
International journal of pharmaceutics, 307(1), 1-8 (2005-11-01)
The purpose of this study was to select the best types of liposomes for use as drug carriers for topical treatment of oral mucosal lesions. Electron paramagnetic resonance (EPR) oximetry, using the paramagnetic probe lithium phthalocyanine, was used in vivo
Zrinka Abramovic et al.
Advances in experimental medicine and biology, 701, 75-82 (2011-03-30)
Tumor hypoxia is a well known therapeutic problem which contributes to radioresistance and aggressive tumor characteristics. Lack of techniques for repeated measurements of tumor oxygenation (pO(2), partial pressure of oxygen) has restricted the optimization of hypoxia modifying methods and their
Synthesis of benzylpalladium complexes through C-O bond cleavage of benzylic carboxylates: Development of a novel palladium-catalyzed benzylation of olefins.
Narahashi H, et al.
Journal of Organometallic Chemistry, 693(2), 283-296 (2008)
Global Trade Item Number
| SKU | GTIN |
|---|---|
| 72351-500ML | 04061837665646 |
| 72351-100ML | 04061837665639 |