uspto-grants-2014_10 · 10.6084/m9.figshare.5104873.v1 · US08853290B2
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IDENTITY
结构与身份
- 标准SMILES
- Oc1ccccc1C(=S)S
- InChIKey
- AJQLEJAVGARHGQ-UHFFFAOYSA-N
- 分子式
- C7H6OS2
- 平均分子量
- 170.3 g/mol
- 单同位素质量
- 169.98600716
COMPUTED
结构计算性质
- XLogP
- 2.2
- 极性表面积
- 53.3 Ų
- 氢键供体
- 2
- 氢键受体
- 3
- 可旋转键
- 1
- 重原子
- 10
- 形式电荷
- 0
- 复杂度
- 136
GHS
GHS分类
GHS Classification
This chemical does not meet GHS hazard criteria for 50% (1 of 2) of reports.
Danger
H315 (50%): Causes skin irritation [Warning Skin corrosion/irritation]；H317 (50%): May cause an allergic skin reaction [Warning Sensitization, Skin]；H318 (50%): Causes serious eye damage [Danger Serious eye damage/eye irritation]；H335 (50%): May cause respiratory irritation [Warning Specific target organ toxicity, single exposure; Respiratory tract irritation]
P261, P264, P264+P265, P271, P272, P280, P302+P352, P304+P340, P305+P354+P338, P317, P319, P321, P332+P317, P333+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.；Reported as not meeting GHS hazard criteria per 1 of 2 reports by companies.；There is 1 notification provided by 1 of 2 reports by companies with hazard statement code(s).；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.
HAZARDS
危害信息
Regulatory Information
Chemical: Benzenecarbodithioic acid, 2-hydroxy-
Hazard Classes and Categories
Skin Irrit. 2 (50%)；Skin Sens. 1 (50%)；Eye Dam. 1 (50%)；STOT SE 3 (50%)
REGULATORY
法规信息
Regulatory Information
Chemical: Benzenecarbodithioic acid, 2-hydroxy-
ALIASES
名称与别名
Dithiosalicylic acid527-89-92-Hydroxydithiobenzoic acid2-hydroxybenzenecarbodithioic acid8LV29H49A3NSC-70157CHEBI:37999DTXSID60870584RefChem:135210DTXCID90204217208-428-1Benzenecarbodithioic acid, 2-hydroxy-Salicylic acid, dithio-UNII-8LV29H49A3EINECS 208-428-1NSC 701572-hydroxybenzene-1-carbodithioic acidAI3-15092Benzenecarbodithioic acid, 2-hydroxy- (9CI)2-hydroxybenzodithioic acid
REACTIONS
