無水スベリン酸

Oxonane-2,9-dione

HCID 9543534

ノート反応

部分構造検索類似構造を探す

基本情報

CAS: 10521-06-9
標準SMILES: O=C1CCCCCCC(=O)O1
InChIKey: RMIBXGXWMDCYEK-UHFFFAOYSA-N
分子式: C8H12O3
平均分子量: 156.18 g/mol
単同位体質量: 156.07864424

名称と識別子

優先名称: Oxonane-2,9-dione
IUPAC: oxonane-2,9-dione
現地名: 無水スベリン酸
英語名: Suberic anhydride
分子式: C8H12O3
分子量: 156.18

名称と別名

OXONANE-2,9-DIONERefChem:857802819-551-0Suberic anhydride10521-06-9KorksaureanhydridSCHEMBL449061DTXSID80429492RMIBXGXWMDCYEK-UHFFFAOYSA-NMFCD18253479AKOS037652171FS165392

名称をさらに表示

スベリン酸無水物無水スベリン酸オキソナン-2,9-ジオン1860902,9-OxonanedioneOxanane-2,9-dioneHexanedicarboxylic anhydride

SY349681DB-009260CS-0376339G21924EN300-1693604F760678

データベース識別子

CAS: 10521-06-9
PubChem CID: 9543534
DTXSID: DTXSID80429492
EC Number: 819-551-0
Nikkaji: J801.598H

物性

構造計算による物性

XLogP: 1.3
極性表面積: 43.4 Å²
水素結合供与体数: 0
水素結合受容体数: 3
回転可能結合数: 0
重原子数: 11
形式電荷: 0
複雑度: 145

物理化学的性質

融点: 65 · 65-66 °C
沸点: 291 · 291.0±9.0 °C(Predicted)
比重(密度): 1.086 · 1.086±0.06 g/cm3(Predicted)

安全と法規制

GHS分類

GHS Classification · 5 件

Warning

H315 (100%): Causes skin irritation [Warning Skin corrosion/irritation]；H319 (100%): Causes serious eye irritation [Warning Serious eye damage/eye irritation]；H335 (100%): May cause respiratory irritation [Warning Specific target organ toxicity, single exposure; Respiratory tract irritation]

P261, P264, P264+P265, P271, P280, P302+P352, P304+P340, P305+P351+P338, P319, P321, P332+P317, P337+P317, P362+P364, P403+P233, P405, and P501 (click each P-code to see the statement)

Aggregated GHS information provided per 2 reports by companies from 2 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.