08436
Butyronitrile
analytical standard
Synonym(s):
Propyl cyanide
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About This Item
Linear Formula:
CH3CH2CH2CN
CAS Number:
Molecular Weight:
69.11
UNSPSC Code:
41116107
NACRES:
NA.24
PubChem Substance ID:
EC Number:
203-700-6
Beilstein/REAXYS Number:
1361452
MDL number:
grade
analytical standard
Quality Level
vapor density
2.4 (vs air)
vapor pressure
23 mmHg ( 25 °C)
assay
≥99.5% (GC)
autoignition temp.
910 °F
shelf life
limited shelf life, expiry date on the label
technique(s)
HPLC: suitable, gas chromatography (GC): suitable
refractive index
n20/D 1.384
bp
115-117 °C (lit.)
mp
−112 °C (lit.)
density
0.794 g/mL at 25 °C (lit.)
application(s)
environmental
format
neat
SMILES string
CCCC#N
InChI
1S/C4H7N/c1-2-3-4-5/h2-3H2,1H3
InChI key
KVNRLNFWIYMESJ-UHFFFAOYSA-N
Application
BTN may be used as a reference standard for the determination of BTN in:
- Whole blood samples obtained from rat and mice by headspace solid-phase microextraction (HS-SPME) followed by analysis using gas chromatography (GC) equipped with nitrogen phosphorus detector (NPD).
- Buckwheat samples by various isolation techniques such as SPME, dynamic headspace (DHS) with cryotrapping or sorbent trapping, headspace sorptive extraction (HSSE), solvent extraction (SE) and simultaneous distillation−extraction (SDE) followed by GC with mass spectrometric (MS) analysis.
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signalword
Danger
hcodes
Hazard Classifications
Acute Tox. 1 Inhalation - Acute Tox. 3 Dermal - Acute Tox. 3 Oral - Flam. Liq. 2
Storage Class
3 - Flammable liquids
wgk
WGK 1
flash_point_f
71.6 °F
flash_point_c
22 °C
ppe
Eyeshields, Faceshields, Gloves, type ABEK (EN14387) respirator filter
Regulatory Information
危险化学品
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Determination of cyanide and volatile alkylnitriles in whole blood by headspace solid-phase microextraction and gas chromatography with nitrogen phosphorus detection
Boadas-Vaello P, et al.
Journal of Chromatography. B, Analytical Technologies in the Biomedical and Life Sciences, 870(1), 17-21 (2008)
Titan's organic aerosols: Molecular composition and structure of laboratory analogues inferred from pyrolysis gas chromatography mass spectrometry analysis
Morisson M, et al.
Icarus, 277, 442-454 (2016)
Comparison of isolation methods for the determination of buckwheat volatile compounds
Prosen H, et al.
Food Chemistry, 121(1), 298-306 (2010)