Quality Segment
assay
98%
bp
132-135 °C/0.5 mmHg (lit.)
mp
96-99 °C (lit.)
functional group
nitrile
SMILES string
Nc1ccc(Cl)cc1C#N
InChI
1S/C7H5ClN2/c8-6-1-2-7(10)5(3-6)4-9/h1-3H,10H2
InChI key
QYRDWARBHMCOAG-UHFFFAOYSA-N
General description
The vibrational spectra of 2-amino-5-chlorobenzonitrile was studied using density functinal theory.
Application
2-Amino-5-chlorobenzonitrile was used to build up the 2,2-dioxide-1H-2,1,3-benzothiadiazine ring system.
signalword
Warning
Hazard Classifications
Acute Tox. 4 Dermal - Acute Tox. 4 Inhalation - Acute Tox. 4 Oral - Aquatic Chronic 3 - Eye Irrit. 2 - Skin Irrit. 2 - STOT SE 3
target_organs
Respiratory system
存储类别
11 - Combustible Solids
wgk
WGK 3
flash_point_f
235.4 °F - closed cup
flash_point_c
113 °C - closed cup
ppe
dust mask type N95 (US), Eyeshields, Gloves