イソシアン化メチル

Methyl isocyanide

HCID 11646CAS 593-75-9

基本情報

標準SMILES
[C-]#[N+]C
InChIKey
ZRKSVHFXTRFQFL-UHFFFAOYSA-N
分子式
C2H3N
平均分子量
41.05 g/mol
単同位体質量
41.0265491

概要

Isocyanomethane is an isocyanide.

名称と識別子

優先名称
Methyl isocyanide
IUPAC
isocyanomethane
現地名
イソシアン化メチル
英語名
METHYL ISOCYANIDE
分子式
C2H3N
分子量
41.05

名称と別名

IsocyanomethaneMETHYL ISOCYANIDE593-75-9Methyl isonitrileMethylisonitrileMethane, isocyano-B5B6DXM7GGCNMeMeNCCH3-NCDTXSID3075040CHEBI:44177
名称をさらに表示
イソシアン化メチル2-アゾニア-1-プロピン-1-イドメチルイソシアニドイソシアノメタンメチルカルビラミンCH3NCMETHANE,ISOCYANO
RefChem:149233DTXCID9042598209-806-9isoacetonitrileMFCD05864413Isoacetonitrile; Methyl IsonitrilemethylisocyanideEINECS 209-806-9

データベース識別子

CAS
593-75-9
PubChem CID
11646
DTXSID
DTXSID3075040
ChEBI
CHEBI:44177
UNII
B5B6DXM7GG
EC Number
209-806-9
Nikkaji
J2.698K

物性

構造計算による物性

XLogP
0
極性表面積
4.4 Ų
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
0
重原子数
3

実験および物理化学的性質

SpringerMaterials PropertiesSchoenflies notation

物理化学的性質

融点
-45 °C · -45°C
沸点
81.65 °C · 81.65°C (estimate)
比重(密度)
0.7424 · 0.7424
屈折率
1.3427 · 1.3427
貯蔵温度
Refrigerator, Under inert atmosphere
溶解性
クロロホルム(可溶)、メタノール(微量)

安全と法規制

GHS分類

GHS Classification · 4 件

Warning

H302 (95%): Harmful if swallowed [Warning Acute toxicity, oral]

P260, P261, P264, P270, P271, P280, P301+P317, P302+P352, P304+P340, P317, P319, P321, P330, P362+P364, and P501 (click each P-code to see the statement)

Aggregated GHS information provided per 40 reports by companies from 3 notifications to the ECHA C&L Inventory. Each notification may be associated with multiple companies.

危険有害性情報

Hazard Classes and CategoriesAcute Tox. 4 (95%)

毒性情報

Treatment · 1 件

Antidotes to cyanide poisoning include hydroxocobalamin and sodium nitrite, which release the cyanide from the cytochrome system, and rhodanase, which is an enzyme occurring naturally in mammals that combines serum cyanide with thiosulfate, producing comparatively harmless thiocyanate. Oxygen therapy can also be administered. (L97)

Health Effects · 1 件

Exposure to high levels of cyanide for a short time harms the brain and heart and can even cause coma, seizures, apnea, cardiac arrest and death. Chronic inhalation of cyanide causes breathing difficulties, chest pain, vomiting, blood changes, headaches, and enlargement of the thyroid gland. Skin contact with cyanide salts can irritate and produce sores. (L96, L97)

Exposure RoutesOral (L96) ; inhalation (L96) ; dermal (L96)
Toxicity Summary · 1 件

Cyanide is an inhibitor of cytochrome c oxidase in the fourth complex of the electron transport chain (found in the membrane of the mitochondria of eukaryotic cells). It complexes with the ferric iron atom in this enzyme. The binding of cyanide to this cytochrome prevents transport of electrons from cytochrome c oxidase to oxygen. As a result, the electron transport chain is disrupted and the cell can no longer aerobically produce ATP for energy. Tissues that mainly depend on aerobic respiration, such as the central nervous system and the heart, are particularly affected. Cyanide is also known produce some of its toxic effects by binding to catalase, glutathione peroxidase, methemoglobin, hydroxocobalamin, phosphatase, tyrosinase, ascorbic acid oxidase, xanthine oxidase, succinic dehydrogenase, and Cu/Zn superoxide dismutase. Cyanide binds to the ferric ion of methemoglobin to form inactive cyanmethemoglobin. (L97)

Signs and SymptomsCyanide poisoning is identified by rapid, deep breathing and shortness of breath, general weakness, giddiness, headaches, vertigo, confusion, convulsions/seizures and eventually loss of consciousness. (L96, L97)
Carcinogen ClassificationNo indication of carcinogenicity to humans (not listed by IARC).

安全データ

ridadr
UN2929
hazard_class
6.1, 3

化学と産業

薬理情報

Metabolism/Metabolites · 1 件

Cyanide is rapidly alsorbed through oral, inhalation, and dermal routes and distributed throughout the body. Cyanide is mainly metabolized into thiocyanate by either rhodanese or 3-mercaptopyruvate sulfur transferase. Cyanide metabolites are excreted in the urine. (L96)

用途と製造

UsesMethyl isocyanide is used for the preparation of various heterocycles. It is also a ligand in organometallic chemistry. (L556)

応用分野

解説CH3NC(41.05).イソシアン化メチル, ヨウ化メチルとシアン化銀とを加熱すると得られる.アセトニトリル様の臭気をもつ有毒な無色の液体.沸点60 ℃.水あるいはアルカリでメチルアミンとギ酸に分解する.爆発性がある.森北出版「化学辞典(第2版)

使用Isocyanomethane can be used as porous embolization microspheres comprising drugs.

サプライヤー9 社

艾吉析科技(上海)有限公司17717235263 · [email protected]
江苏艾康生物医药研发有限公司025-025-66113011 15955137747 · [email protected]
上海迈瑞尔生化科技有限公司4006356688 18621169109 · [email protected]
上海皓鸿生物医药科技有限公司400-8210725 4008210725 · [email protected]
韶远科技(上海)有限公司021-50795510 4000665055 · [email protected]

関連反応

31 件

関連ノート

読み込み中…