4-メトキシ-2-ニトロベンゼンスルホニルクロリド

4-Methoxy-2-nitrobenzenesulphonyl chloride

HCID 87452

ノート反応

部分構造検索類似構造を探す

基本情報

CAS: 18092-54-1
標準SMILES: COc1ccc(S(=O)(=O)Cl)c([N+](=O)[O-])c1
InChIKey: OGHAPVZVXLHURO-UHFFFAOYSA-N
分子式: C7H6ClNO5S
平均分子量: 251.64 g/mol
単同位体質量: 250.9655212

名称と識別子

優先名称: 4-Methoxy-2-nitrobenzenesulphonyl chloride
IUPAC: 4-methoxy-2-nitrobenzenesulfonyl chloride
現地名: 4-メトキシ-2-ニトロベンゼンスルホニルクロリド
英語名: 4-Methoxy-2-nitrobenzenesulfonyl chloride
分子式: C7H6ClNO5S
分子量: 251.64

名称と別名

4-Methoxy-2-nitrobenzenesulfonyl Chloride18092-54-14-Methoxy-2-nitrobenzenesulphonyl chlorideEINECS 241-996-9DTXSID70171039RefChem:524552DTXCID2093530241-996-94-methoxy-2-nitrobenzene-1-sulfonyl chlorideMFCD00143333Benzenesulfonyl chloride, 4-methoxy-2-nitro-4-methoxy-2-nitro-benzenesulfonyl chloride

名称をさらに表示

4-メトキシ-2-ニトロベンゼンスルホニルクロリド2-ニトロ-4-メトキシベンゼンスルホニルクロリド4-メトキシ-2-ニトロベンゼン-1-スルホニルクロリドmethoxynitrobenzenesulfonylchloride4-Methoxy-2-nitrobenzenesulfonylChloride>Benzenesulfonyl chloride, 4-methoxy-2-nitro-5-iodo-4-methoxy-1-(2-oxolanyl)-2-pyrimidinone4-METHOXY-2-NITROBENZENESULFONYL CHLORIDE, 93+%

GS-43094-Methoxy-2-nitrobenzenesulfonylchlorideAM20060854FT-0637648SCHEMBL540736SBB055012AKOS001359232chloro(4-methoxy-2-nitrophenyl)sulfone

データベース識別子

CAS: 18092-54-1
PubChem CID: 87452
DTXSID: DTXSID70171039
EC Number: 241-996-9
Nikkaji: J256.613C

物性

構造計算による物性

XLogP: 1.8
極性表面積: 97.6 Å²
水素結合供与体数: 0
水素結合受容体数: 5
回転可能結合数: 2
重原子数: 15
形式電荷: 0
複雑度: 332

物理化学的性質

融点: 78 °C · 78°C
貯蔵温度: 2 · under inert gas (nitrogen or Argon) at 2-8°C
外見: powder to crystal
色: Light orange to Yellow to Green

安全と法規制

GHS分類

GHS Classification · 5 件

Danger

H290 (33.3%): May be corrosive to metals [Warning Corrosive to Metals]；H314 (100%): Causes severe skin burns and eye damage [Danger Skin corrosion/irritation]；H317 (33.3%): May cause an allergic skin reaction [Warning Sensitization, Skin]；H318 (66.7%): Causes serious eye damage [Danger Serious eye damage/eye irritation]；H335 (33.3%): May cause respiratory irritation [Warning Specific target organ toxicity, single exposure; Respiratory tract irritation]

P234, P260, P261, P264, P264+P265, P271, P272, P280, P301+P330+P331, P302+P352, P302+P361+P354, P304+P340, P305+P354+P338, P316, P317, P319, P321, P333+P317, P362+P364, P363, P390, P403+P233, P405, P406, and P501 (click each P-code to see the statement)

Aggregated GHS information provided per 3 reports by companies from 3 notifications to the ECHA C&L Inventory. Each notification may be associated with multiple companies.；Information may vary between notifications depending on impurities, additives, and other factors. The percentage value in parenthesis indicates the notified classification ratio from companies that provide hazard codes. Only hazard codes with percentage values above 10% are shown. For more detailed information, please visit ECHA C&L website.