2-Iodobenzoyl chloride (HCID 69112)

名称と識別子

優先名称: 2-Iodobenzoyl chloride
IUPAC: 2-iodobenzoyl chloride
現地名: 2-ヨードベンゾイルクロリド
英語名: 2-IODOBENZOYL CHLORIDE
分子式: C7H4ClIO
分子量: 266.46

名称と別名

2-Iodobenzoyl chloride609-67-6Benzoyl chloride, 2-iodo-EINECS 210-196-1DTXSID4060573Benzoyl chloride, 2iodoRefChem:473773DTXCID5042906210-196-12-iodobenzoylchlorideo-Iodobenzoyl chlorideMFCD00001040

名称をさらに表示

2-ヨードベンゾイルクロリド2-ヨード安息香酸クロリドO-ヨードベンゾイル=クロリド塩化2-ヨードベンゾイルSKL12152-iodo-benzoylchlorid2-IodobenzoylChloride>Benzoyl chloride, 2-iodo-2-Iodobenzoylchloride,97%2-Iodobenzoic acid chloride9-(phenylmethyl)phenanthrene2-Iodobenzoyl chloride, 98+%

iodobenzoyl chlorideo-iodobenzoylchloride2-iodobezoyl chlorideo-iodo-benzoylchloride2-iodobenzoic chloride2-iodo-benzoyl chloride2-iodo-benzoic acid chlorideSCHEMBL502454

データベース識別子

CAS: 609-67-6
PubChem CID: 69112
DTXSID: DTXSID4060573
EC Number: 210-196-1
Nikkaji: J96.174D

物性

構造計算による物性

XLogP: 3.4
極性表面積: 17.1 Å²
水素結合供与体数: 0
水素結合受容体数: 1
回転可能結合数: 1
重原子数: 10
形式電荷: 0
複雑度: 138

実験および物理化学的性質

Chemical ClassesToxic Gases & Vapors -> Acid Halides

Physical DescriptionOff-white solid; mp = 27-32 deg C; [Alfa Aesar MSDS]

物理化学的性質

融点: 27 · 27-31 °C(lit.)
沸点: 105 · 105-106 °C1 mm Hg(lit.)
比重(密度): 1.932 · 1.932
闪点: 110 °C · >110°C
貯蔵温度: 2 · Keep in dark place,Inert atmosphere,2-8°C
溶解性: soluble in Toluene
外見: powder to lump
色: White to Light yellow to Dark green
水溶解度: 水と反応する。
BRN: 2042672 · 2042672
InChI: 1S/C7H4ClIO/c8-7(10)5-3-1-2-4-6(5)9/h1-4H
InChIKey: MVIVDSWUOGNODP-UHFFFAOYSA-N
SMILES: ClC(=O)c1ccccc1I
CAS データベース: 609 · 609-67-6(CAS DataBase Reference)
EPAの化学物質情報: 2 · Benzoyl chloride, 2-iodo- (609-67-6)

化学的性質

化学的特性white to pinkish or pale yellow crystalline

安全と法規制

GHS分類

GHS Classification · 4 件

Danger

H314 (100%): Causes severe skin burns and eye damage [Danger Skin corrosion/irritation]

P260, P264, P280, P301+P330+P331, P302+P361+P354, P304+P340, P305+P354+P338, P316, P321, P363, P405, and P501 (click each P-code to see the statement)

Aggregated GHS information provided per 46 reports by companies from 4 notifications to the ECHA C&L Inventory.

危険有害性情報

Regulatory Information2-Iodobenzoyl chloride: Does not have an individual approval but may be used under an appropriate group standard

Hazards SummaryReacts with water; Causes burns; Inhalation may cause corrosive injuries to upper respiratory tract and lungs; [Alfa Aesar MSDS] See Benzoyl chloride.

Hazard Classes and CategoriesSkin Corr. 1B (100%)

毒性情報

Adverse EffectsDermatotoxin - Skin burns.

安全データ

F: 21-19
wgk: 3
tsca: TSCA listed
ridadr: UN 3261 8/PG 2
hs_code: 29163990
risk_code: 34
hazard_code: C
safety_code: 26-36/37/39-45
hazard_class: 8
packing_group: II
Hazard Classifications: Eye Dam. 1Skin Corr. 1B
ストレージクラス: 8A - Combustible corrosive hazardous materials

化学と産業

用途と製造

General Manufacturing InformationBenzoyl chloride, 2-iodo-: INACTIVE

応用分野 · 1 件

使用2-Iodobenzoyl chloride has been used in palladium-catalyzed synthesis of carbomethoxy functional group-induced isoindolin-1-ones, preparation of starting materials required for the synthesis of novel cyclic derivatives of pentavalent iodine, benziodazole oxides.