6-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)benzo[d]oxazol-2(3H)-one

HCID 57950637

ノート反応

部分構造検索類似構造を探す

基本情報

CAS: 1105710-32-4
標準SMILES: CC1(C)OB(c2ccc3[nH]c(=O)oc3c2)OC1(C)C
InChIKey: RVSGJKHNWXFXCD-UHFFFAOYSA-N
分子式: C13H16BNO4
平均分子量: 261.08 g/mol
単同位体質量: 261.1172382

名称と識別子

優先名称: 6-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)benzo[d]oxazol-2(3H)-one
IUPAC: 6-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)-3H-1,3-benzoxazol-2-one
英語名: 2-oxo-2,3-dihydrobenzo[d]oxazol-6-ylboronic acid pinacol ester
分子式: C13H16BNO4
分子量: 261.08

名称と別名

1105710-32-46-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)benzo[d]oxazol-2(3H)-one2-Oxo-2,3-dihydrobenzoxazole-6-boronic Acid Pinacol EsterMFCD131820732-OXO-2,3-DIHYDROBENZO[D]OXAZOL-6-YLBORONIC ACID PINACOL ESTER6-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)-3H-1,3-benzoxazol-2-oneSCHEMBL1519980RVSGJKHNWXFXCD-UHFFFAOYSA-NFUB71032AC2935MB12755AS-78145

名称をさらに表示

(2-Oxo-2,3-dihydro-1,3-benzoxazol-6-yl)boronic acid pinacol ester2(3H)-Benzoxazolone, 6-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)-

DA-15537SY130171CS-0112864EN300-125244F606860Z15747378386-(tetramethyl-1,3,2-dioxaborolan-2-yl)-2,3-dihydro-1,3-benzoxazol-2-one

データベース識別子

CAS: 1105710-32-4
PubChem CID: 57950637
EC Number: 883-699-2

物性

構造計算による物性

極性表面積: 56.8 Å²
水素結合供与体数: 1
水素結合受容体数: 4
回転可能結合数: 1
重原子数: 19
形式電荷: 0
複雑度: 382

物理化学的性質

融点: 223 °C · >223°C (dec.)
貯蔵温度: -20 °C · -20°C Freezer, Under inert atmosphere
溶解性: クロロホルム（微量）、メタノール（微量）
外見: 個体
色: ホワイトからオフホワイト

安全と法規制

GHS分類

GHS Classification · 5 件

Warning

H302 (100%): Harmful if swallowed [Warning Acute toxicity, oral]；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, P270, P271, P280, P301+P317, P302+P352, P304+P340, P305+P351+P338, P319, P321, P330, 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 1 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.

危険有害性情報

Hazard Classes and CategoriesAcute Tox. 4 (100%)；Skin Irrit. 2 (100%)；Eye Irrit. 2A (100%)；STOT SE 3 (100%)

安全データ

注意喚起語: 警告
危険有害性情報: コード危険有害性情報危険有害性クラス区分注意喚起語シンボル P コード H302

化学と産業

サプライヤー20 社

韶远科技（上海）有限公司021-50795510 4000665055 · [email protected]

苏州施亚生物科技有限公司17715136450 · [email protected]

苏州迪飞医药科技有限公司18651107528 18651107528 · [email protected]

康姆芘法思（上海）生物科技有限公司021-65232103 17602124823 · [email protected]

上海健超生物科技有限公司150-2103-5486 18017383231 · [email protected]

化合物ノート

読み込み中…