130621
Glutaronitrile
99%
Synonym(s):
1,3-Dicyanopropane
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About This Item
Linear Formula:
NC(CH2)3CN
CAS Number:
Molecular Weight:
94.11
UNSPSC Code:
12352100
NACRES:
NA.22
PubChem Substance ID:
EC Number:
208-861-6
Beilstein/REAXYS Number:
1738385
MDL number:
Assay:
99%
Form:
liquid
Quality Level
assay
99%
form
liquid
refractive index
n20/D 1.434 (lit.)
bp
285-287 °C (lit.)
mp
−29 °C (lit.)
solubility
H2O: soluble, alcohol: soluble, chloroform: soluble
density
0.995 g/mL at 25 °C (lit.)
functional group
nitrile
SMILES string
N#CCCCC#N
InChI
1S/C5H6N2/c6-4-2-1-3-5-7/h1-3H2
InChI key
ZTOMUSMDRMJOTH-UHFFFAOYSA-N
Application
Glutaronitrile can be used as:
- An electrolyte additive in high energy/power Li-ion batteries.
- A glutarate ligand source to prepare zinc glutarate (ZnGA) by reacting with zinc perchlorate hexahydrate.
- A reactant to synthesize pentanedithioamide by reacting with Lawesson′s reagent in the presence of boron trifluoride etherate (BF3.OEt2).
Glutaronitrile (1,3-Dicyanopropane) was used in the preparation of dicarbonyl compounds.
signalword
Danger
hcodes
Hazard Classifications
Acute Tox. 3 Oral
Storage Class
6.1C - Combustible acute toxic Cat.3 / toxic compounds or compounds which causing chronic effects
wgk
WGK 3
flash_point_f
233.6 °F - closed cup
flash_point_c
112 °C - closed cup
ppe
Eyeshields, Faceshields, Gloves, type ABEK (EN14387) respirator filter
Regulatory Information
危险化学品
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γ-butyrolactone and glutaronitrile as 5 V electrolyte additive and its electrochemical performance for LiNi0. 5Mn1. 5O4
Xu Yun, et al.
Journal of alloys and compounds, 698, 207-214 (2017)
Xingyong Wang et al.
The Journal of organic chemistry, 78(11), 5273-5281 (2013-05-15)
A palladium-catalyzed addition of potassium aryltrifluoroborates to aliphatic nitriles has been developed, leading to a wide range of alkyl aryl ketones with moderate to excellent yields. Moreover, several dinitriles (e.g., malononitrile, glutaronitrile, and adiponitrile) were applicable to this process for
Hydrothermal synthesis of single-crystalline zinc glutarate and its structural determination
Kim Jong-Seong, et al.
Chemistry of Materials, 16(16), 2981-2983 (2004)
Global Trade Item Number
| SKU | GTIN |
|---|---|
| 130621-25ML | 04061838345769 |
| 130621-100ML | 04061838345752 |