모든 사진(1)
About This Item
Linear Formula:
F2C6H3CN
CAS Number:
Molecular Weight:
139.10
EC Number:
MDL number:
UNSPSC 코드:
12352100
PubChem Substance ID:
NACRES:
NA.22
양식:
solid
분석:
99%
추천 제품
Quality Level
분석
99%
양식
solid
mp
84-86 °C (lit.)
작용기
fluoro
nitrile
SMILES string
Fc1cc(F)cc(c1)C#N
InChI
1S/C7H3F2N/c8-6-1-5(4-10)2-7(9)3-6/h1-3H
InChI key
CQXZSEXZQVKCHW-UHFFFAOYSA-N
일반 설명
The vibrational wavenumbers, geometry and various thermodynamic parameters were studied for 3,5-difluorobenzonitrile.
신호어
Warning
유해 및 위험 성명서
Hazard Classifications
Acute Tox. 4 Dermal - Acute Tox. 4 Inhalation - Acute Tox. 4 Oral - Eye Irrit. 2 - Skin Irrit. 2 - STOT SE 3
표적 기관
Respiratory system
Storage Class Code
11 - Combustible Solids
WGK
WGK 3
Flash Point (°F)
Not applicable
Flash Point (°C)
Not applicable
개인 보호 장비
dust mask type N95 (US), Eyeshields, Gloves
V K Rastogi et al.
Spectrochimica acta. Part A, Molecular and biomolecular spectroscopy, 58(9), 1987-2004 (2002-08-08)
Geometry, vibrational wavenumbers and several thermodynamic parameters were calculated using ab initio quantum chemical methods for the 3,5-difluorobenzonitrile molecule. The results were compared with the experimental values. With the help of three specific scaling procedures, the observed vibrational wavenumbers in
Mounggon Kim et al.
Chemistry (Weinheim an der Bergstrasse, Germany), 25(7), 1829-1834 (2018-11-27)
Molecular design principles of thermally activated delayed fluorescent (TADF) emitters having a high quantum efficiency and a color tuning capability was investigated by synthesizing three TADF emitters with donors at different positions of a benzonitrile acceptor. The position rendering a
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