405280

2-氨基-4-氯苄腈

99%

• 同義詞: 4-氯邻氨基苯腈, 5-氯-2-氰基苯胺
• 線性公式: H₂NC₆H₃(Cl)CN
• CAS號碼: 38487-86-4
• 分子量：: 152.58
• Beilstein: 2085559
• EC號碼: 253-967-8
• MDL號碼: MFCD00035927
• 分類程式碼代碼: 12352100
• PubChem物質ID: 24865306
• NACRES: NA.22

屬性

• 品質等級: 100
• 化驗: 99%
• 形狀: powder
• mp: 157-162 °C (lit.)
• 官能基: chloro; nitrile
• SMILES 字串: Nc1cc(Cl)ccc1C#N
• InChI: 1S/C7H5ClN2/c8-6-2-1-5(4-9)7(10)3-6/h1-3H,10H2
• InChI 密鑰: UZHALXIAWJOLLR-UHFFFAOYSA-N

描述

一般說明

2-Amino-4-chlorobenzonitrile (2A4CBN) is a benzonitrile derivative. A study of the molecular structure, vibrational spectra and NBO analysis of 2A4CBN has been undertaken. Transformation of 2A4CBN into quinazoline-2,4(1H,3H)-diones at atmospheric pressure of CO₂ in the presence of monomeric tungstate, TBA₂[WO₄] (TBA = tetra-n-butylammonium) has been reported.

應用

2-Amino-4-chlorobenzonitrile may be used in the preparation of the following:

• 6-chloro-4-(1-diethylamino-4-pentylamino)-2-(p-methoxyphenyl)-quinazoline dihydrochloride
• 7-chloro-4-(1-diethylamino-4-pentylamino)-2-(p-methoxyphenyl)-quinazoline dihydrochloride
• 4,7-dichloro-2-(2-methylprop-1-enyl)-6-nitroquinazoline
• 6-chlorotacrine
• N-(2-chloro-5-cyanophenyl)-4,4,4-trifluorobutanamide

安全資訊

• 象形圖: GHS07
• 訊號詞: Warning
• 危險聲明: H315,H319,H335
• 防範說明: P261 - P264 - P271 - P280 - P302 + P352 - P305 + P351 + P338
• 危險分類: Eye Irrit. 2 - Skin Irrit. 2 - STOT SE 3
• 標靶器官: Respiratory system
• 儲存類別代碼: 11 - Combustible Solids
• 水污染物質分類（WGK）: WGK 3
• 閃點（°F）: Not applicable
• 閃點（°C）: Not applicable
• 個人防護裝備: dust mask type N95 (US), Eyeshields, Gloves