CAS 4582-21-2 (2-endo,3-exo)-Bicyclo(2.2.1)hept-5-ene-2,3-dicarbonyl dichloride (HCID 98325)

基本情報

CAS: 4582-21-2
標準SMILES: O=C(Cl)C1C2C=CC(C2)C1C(=O)Cl
InChIKey: KANQIAARVSWKKG-UHFFFAOYSA-N
分子式: C9H8Cl2O2
平均分子量: 219.06 g/mol
単同位体質量: 217.99013486

名称と識別子

優先名称: (2-endo,3-exo)-Bicyclo(2.2.1)hept-5-ene-2,3-dicarbonyl dichloride
IUPAC: bicyclo[2.2.1]hept-5-ene-2,3-dicarbonyl chloride
現地名: rel-(1α*,4α*)-ビシクロ[2.2.1]ヘプタ-5-エン-2β*,3α*-ジカルボン酸ジクロリド
英語名: trans-5-Norbornene-2,3-dicarbonyl chloride
分子式: C9H8Cl2O2
分子量: 219.06

名称と別名

(2-endo,3-exo)-Bicyclo(2.2.1)hept-5-ene-2,3-dicarbonyl dichloride(2-endo,3-exo)-bicyclo[2.2.1]hept-5-ene-2,3-dicarbonyl dichlorideRefChem:395743224-967-5707-80-24582-21-25-Norbornene-2,3-dicarbonyl chloride, trans-bicyclo[2.2.1]hept-5-ene-2,3-dicarbonyl chlorideBicyclo[2.2.1]hept-5-ene-2,3-dicarbonyl dichloride5-Norbornene-2,3-dicarbonyl ChlorideBicyclo[2.2.1]hept-2-ene-5,6-dicarbonyldichlorideMFCD00167567

名称をさらに表示

trans-5-ノルボルネン-2,3-ジカルボニルクロリドrel-(1α*,4α*)-ビシクロ[2.2.1]ヘプタ-5-エン-2β*,3α*-ジカルボン酸ジクロリド塩化TRANS-3,6-ENDO-メチレン-1,2,3,6-テトラヒドロフタロイルビシクロ[2.2.1]-5-ヘプテン-2,3-ジカルボニルクロリドtrans-5-norbornene-3-dicarbonylchloridetrans-5-Norbornene-2,3-dicarbonyl chloride3,6-ENDOMETHYLENE-1,2,3,6-TETRAHYDROPHTHALOYL CHLORIDETRANS-3,6-ENDO-METHYLENE-1,2,3,6-TETRAHYDROPHTHALOYL CHLORIDEtrans-3,6-endo-Methylene-1,2,3,6-tetrahydrophthaloyl chloride,97%

trans-Bicyclo(2.2.1)hept-5-enyl-2,3-dicarbonylchlorideBicyclo[2.2.1]-5-heptene-2,3-dicarbonyl chlorideEINECS 224-967-5Bicyclo(2.2.1)hept-5-ene-2,3-dicarbonyl dichloride, (2-endo,3-exo)-NSC 103156BRN 3134243Bicyclo[2.2.1]hept-5-ene-2,3-dicarbonyl dichloride, (2-endo,3-exo)-3-09-00-04048 (Beilstein Handbook Reference)

物性

構造計算による物性

XLogP: 2.3
極性表面積: 34.1 Å²
水素結合供与体数: 0
水素結合受容体数: 2
回転可能結合数: 2
重原子数: 13
形式電荷: 0
複雑度: 270

物理化学的性質

沸点: 114 · 114-118 °C/11 mmHg (lit.)
比重(密度): 1.349 g/mL · 1.349 g/mL at 25 °C (lit.)
屈折率: 20 · n20/D 1.517(lit.)
闪点: 230 °F · >230 °F
InChI: 1S/C9H8Cl2O2/c10-8(12)6-4-1-2-5(3-4)7(6)9(11)13/h1-2,4-7H,3H2/t4-,5+,6-,7-/m1/s1
InChIKey: KANQIAARVSWKKG-XZBKPIIZSA-N
SMILES: ClC(=O)[C@@H]1[C@@H]2C[C@@H](C=C2)[C@H]1C(Cl)=O
CAS データベース: 4582 · 4582-21-2

化学的性質

化学的特性CLEAR COLOURLESS TO YELLOWISH LIQUID

安全と法規制

GHS分類

GHS Classification · 4 件

Danger

H312 (100%): Harmful in contact with skin [Warning Acute toxicity, dermal]

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

Aggregated GHS information provided per 39 reports by companies from 1 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 (100%)

安全データ

wgk: 3
rtecs: RB8225000
ridadr: UN 3265 8/PG 2
毒性: LD50 orl-rat: 1830 mg/kg TXAPA9 28,313,74
hs_code: 29172000
risk_code: 20/21/22-34
hazard_code: C
safety_code: 23-26-28-36/37/39-45
hazard_class: 8
packing_group: III
Hazard Classifications: Acute Tox. 4 DermalSkin Corr. 1B
ストレージクラス: 8A - Combustible corrosive hazardous materials

化学と産業

応用分野 · 1 件

一般的な説明Trans-3,6-endomethylene-1,2,3,6-tetrahydrophthaloyl chloride (tNBDC, trans-5-Norbornene-2,3-dicarbonyl chloride) undergoes interfacial polymerization reaction with 1,3-diaminopropane on the surface of a modified polyacrylonitrile (mPAN) during the fabrication of DAPE-SCC/mPAN or DAPE-tNBDC/mPAN TFC membranes.

サプライヤー11 社

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化合物ノート

読み込み中…

rel-(1α,4α)-ビシクロ[2.2.1]ヘプタ-5-エン-2β,3α-ジカルボン酸ジクロリド