CAS 1028748-08-4 (2,2-Dimethyl-2,3-dihydro-1-benzofuran-5-yl)boronic acid (HCID 23005350)

基本情報

CAS: 1028748-08-4
標準SMILES: CC1(C)Cc2cc(B(O)O)ccc2O1
InChIKey: APZZJRJOSLSLLR-UHFFFAOYSA-N
分子式: C10H13BO3
平均分子量: 192.02 g/mol

名称と識別子

優先名称: (2,2-Dimethyl-2,3-dihydro-1-benzofuran-5-yl)boronic acid
IUPAC: (2,2-dimethyl-3H-1-benzofuran-5-yl)boronic acid

名称と別名

1028748-08-4(2,2-DIMETHYL-2,3-DIHYDRO-1-BENZOFURAN-5-YL)BORONIC ACIDRefChem:394415990-583-6(2,2-dimethyl-2,3-dihydrobenzofuran-5-yl)boronic acid(2,2-dimethyl-3H-benzofuran-5-yl)boronic acid2,2-Dimethyl-2,3-dihydrobenzofurane-5-boronic Acid(2,2-dimethyl-3H-1-benzofuran-5-yl)boronic acidSCHEMBL1371172(2,2-dimethyl-2,3-dihydro-1-benzofuran-5-yl)boranediolB-(2,3-dihydro-2,2-dimethyl-5-benzofuranyl)Boronic acidAPZZJRJOSLSLLR-UHFFFAOYSA-N

名称をさらに表示

MFCD06801719AKOS004113934AB30160AS-95049DA-16161SY397728CS-0279319EN300-79668

データベース識別子

CAS: 1028748-08-4
PubChem CID: 23005350
EC Number: 990-583-6

物性

構造計算による物性

極性表面積: 49.7 Å²
水素結合供与体数: 2
水素結合受容体数: 3
回転可能結合数: 1
重原子数: 14
形式電荷: 0
複雑度: 217

安全と法規制

GHS分類

GHS Classification · 4 件

Warning

H302 (100%): Harmful if swallowed [Warning Acute toxicity, oral]

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)

The GHS information provided by 1 company from 1 notification to the ECHA C&L Inventory.