Dibenzofuran-2-sulphonic acid 分子结构式
HCID522803

Dibenzofuran-2-sulphonic acid

dibenzofuran-2-sulfonic acid

C12H8O4S248.26 g/molCAS 83863-63-2

IDENTITY

结构与身份

标准SMILES
O=S(=O)(O)c1ccc2oc3ccccc3c2c1
InChIKey
JANFYPHFIPGYTQ-UHFFFAOYSA-N
分子式
C12H8O4S
平均分子量
248.26 g/mol
单同位素质量
248.01432991

COMPUTED

结构计算性质

已同步
XLogP
2.9
极性表面积
75.9 Ų
氢键供体
1
氢键受体
4
可旋转键
1
重原子
17
形式电荷
0
复杂度
386

GHS

GHS分类

来源:PubChem
GHS Classification

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 4 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.

ALIASES

名称与别名

共 25 条
83863-63-22-Dibenzofuransulfonic acidDibenzofuran-2-sulphonic acidEINECS 281-128-6DTXSID20232760RefChem:586411DTXCID50155251281-128-6Dibenzo[b,d]furan-2-sulfonic acidDIBENZOFURAN-2-SULFONIC ACIDMFCD00092344QVQ3YZG4ZUDibenzofuran-2-sulfonsaureSCHEMBL2818655JANFYPHFIPGYTQ-UHFFFAOYSA-MFCD09953666SBB040930Dibenzo[b,d]furan-2-sulfonic acid #AKOS000269062AS-77588

REACTIONS

参与反应

6
HRID 207312 反应方程式

Training data from https://doi.org/10.1039/C8SC04228D (6/10) · 10.1039/C8SC04228D

查看
HRID 234352 反应方程式

uspto-grants-1997_01 · 10.6084/m9.figshare.5104873.v1 · US05594021

查看
HRID 1166863 反应方程式

uspto-grants-2003_09 · 10.6084/m9.figshare.5104873.v1 · US06613804B2

查看
HRID 1251700 反应方程式

uspto-grants-2002_01 · 10.6084/m9.figshare.5104873.v1 · US06342610B2

查看
HRID 1738441 反应方程式

uspto-grants-1999_10 · 10.6084/m9.figshare.5104873.v1 · US05962490

查看
HRID 2270625 反应方程式

uspto-grants-2001_12 · 10.6084/m9.figshare.5104873.v1 · US06331637B1

查看