assay
98%
form
solid
bp
170 °C/12 mmHg (lit.)
mp
39-42 °C (lit.)
functional group
chloro, nitrile
SMILES string
Clc1ccc(CC#N)cc1Cl
InChI
1S/C8H5Cl2N/c9-7-2-1-6(3-4-11)5-8(7)10/h1-2,5H,3H2
InChI key
QWZNCAFWRZZJMA-UHFFFAOYSA-N
Application
3,4-Dichlorophenylacetonitrile was used in the synthesis of:
- SR 48968, a potent, competitive and selective non-peptide antagonist of the neurokinin A (NK2) receptor
- tachykinin NK3 receptor antagonist SR 142801, (R)-N-[ 1-[3-[ 1-benzoyl-3-(3,4-dichlororphenyl)-3-piperidinyl]propyyl]-4-phenyl-4-piperidinyl-N-methyl acetamide
- MDL 105,212, a non-peptide tachykinin receptor antagonist
警示词
Warning
Hazard Classifications
Acute Tox. 4 Dermal - Acute Tox. 4 Inhalation - Acute Tox. 4 Oral - Eye Irrit. 2 - Skin Irrit. 2 - STOT SE 3
靶器官
Respiratory system
存储类别
11 - Combustible Solids
怎么回事?
WGK 3
闪点 (F)
235.4 °F - closed cup
闪点 (°C)
113 °C - closed cup
PPE(个人防护设备)
dust mask type N95 (US), Eyeshields, Gloves
