306118
3-Pentenenitrile, predominately trans
95%
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About This Item
Linear Formula:
CH3CH=CHCH2CN
CAS Number:
Molecular Weight:
81.12
NACRES:
NA.22
PubChem Substance ID:
UNSPSC Code:
12352100
MDL number:
Assay:
95%
Form:
liquid
assay
95%
form
liquid
InChI
1S/C5H7N/c1-2-3-4-5-6/h2-3H,4H2,1H3/b3-2+
SMILES string
[H]\C(C)=C(\[H])CC#N
InChI key
UVKXJAUUKPDDNW-NSCUHMNNSA-N
vapor pressure
24.9 mmHg ( 50 °C)
refractive index
n20/D 1.422 (lit.)
bp
144-147 °C (lit.)
density
0.837 g/mL at 25 °C (lit.)
Quality Level
Related Categories
General description
The infrared spectra of solid, gaseous and liquid and solid trans 3-pentenenitrile were studied.
Application
trans-3-Pentenenitrile was used to study the sensory and motor conduction velocities (SCV and MCV) and amplitudes of the motor and sensory action potentials (AMAP and ASAP) of the tail nerve in male Sprague-Dawley rats.
Legal Information
DuPont product
signalword
Danger
hcodes
Hazard Classifications
Acute Tox. 3 Inhalation - Acute Tox. 4 Oral - Flam. Liq. 3
Storage Class
3 - Flammable liquids
wgk
WGK 3
flash_point_f
104.0 °F - closed cup
flash_point_c
40 °C - closed cup
ppe
Eyeshields, Faceshields, Gloves, type ABEK (EN14387) respirator filter
Regulatory Information
危险化学品
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Conformational stability from variable temperature FT-IR spectra of xenon solutions and ab initio calculations of trans-3-pentenenitrile and 3-methyl-3-butene nitrile.
Journal of Molecular Structure, 563, 551-554 (2001)
F Gagnaire et al.
Journal of applied toxicology : JAT, 18(1), 25-31 (1998-04-04)
Motor and sensory conduction velocities (MCV and SCV) and amplitudes of the sensory and motor action potentials (ASAP and AMAP) of the tail nerve were studied in male Sprague-Dawley rats during chronic oral treatment with five unsaturated aliphatic nitriles. Rats
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