2,6-ジクロロベンゼンチオール

Benzenethiol, 2,6-dichloro-

HCID 90671
ノート反応
部分構造検索類似構造を探す

基本情報

CAS
24966-39-0
標準SMILES
Sc1c(Cl)cccc1Cl
InChIKey
JBISHCXLCGVPGW-UHFFFAOYSA-N
分子式
C6H4Cl2S
平均分子量
179.07 g/mol
単同位体質量
177.9410767

名称と識別子

優先名称
Benzenethiol, 2,6-dichloro-
IUPAC
2,6-dichlorobenzenethiol
現地名
2,6-ジクロロベンゼンチオール
英語名
2,6-DICHLOROTHIOPHENOL
分子式
C6H4Cl2S
分子量
179.07

名称と別名

2,6-Dichlorobenzenethiol2,6-DichlorothiophenolBenzenethiol, 2,6-dichloro-DTXSID60179680RefChem:565084DTXCID20102171416-720-724966-39-02,6-dichlorobenzene-1-thiol2,6-Dichloro thiophenolMFCD000048332,6-dichloro-benzenethiol
名称をさらに表示
2,6-ジクロロベンゼンチオール2,6-ジクロロチオフェノール2,6-ジクロロチオフェノ-ル2,6-ジクロロベンゼンチオール ジクロロチオフェノール 塩化物2,6-ジクロロベンゼン-1-チオール2,6-DICHLOROTHIOPHEN2,6-Dichlorothiophenol98%2,6 - Dichloro Thiophenole2,6-Dichlorothiophenol 98%2,6-dichlorobenzenethiolate2,6-Dichlorophenyl mercaptan2,6-Dichlorobenzenethiol,97%
SCHEMBL190658AKOS000121486s10969F0001-0842Z56347203AMY256242,6-dichlorobenzene-1-thi4-Thiazolecarboxylic acid, 5-ethyl-, ethyl ester

データベース識別子

CAS
24966-39-0
PubChem CID
90671
DTXSID
DTXSID60179680
EC Number
416-720-7、670-334-5
Nikkaji
J208.436H

物性

構造計算による物性

XLogP
3.3
極性表面積
1 Ų
水素結合供与体数
1
水素結合受容体数
1
回転可能結合数
0
重原子数
9

物理化学的性質

融点
48 · 48-50 °C(lit.)
沸点
119 · 119-120 °C (10 mmHg)
比重(密度)
1.3905 · 1.3905 (estimate)
闪点
230 °F · >230 °F
貯蔵温度
30 °C · Store below +30°C.
外見
個体

化学的性質

化学的特性yellow crystals or chunks

安全と法規制

GHS分類

GHS Classification · 6 件

Warning

H302 (14.3%): Harmful if swallowed [Warning Acute toxicity, oral]；H312 (14.3%): Harmful in contact with skin [Warning Acute toxicity, dermal]；H315 (100%): Causes skin irritation [Warning Skin corrosion/irritation]；H319 (100%): Causes serious eye irritation [Warning Serious eye damage/eye irritation]；H332 (14.3%): Harmful if inhaled [Warning Acute toxicity, inhalation]；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, P317, 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 7 reports by companies from 4 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

Regulatory Information · 2 件

Status: Active Update: 10-11-2008 https://echa.europa.eu/registration-dossier/-/registered-dossier/3625

2,6-Dichlorothiophenol: Does not have an individual approval but may be used under an appropriate group standard

Hazard Classes and Categories · 2 件

Acute Tox. 4 (25%)；Acute Tox. 4 (25%)；Skin Irrit. 2 (100%)；Eye Irrit. 2A (100%)；Acute Tox. 4 (25%)；STOT SE 3 (75%)

Acute Tox. 4 (14.3%)；Acute Tox. 4 (14.3%)；Skin Irrit. 2 (100%)；Eye Irrit. 2 (100%)；Acute Tox. 4 (14.3%)；STOT SE 3 (100%)

法規制情報

Regulatory Information · 2 件

Status: Active Update: 10-11-2008 https://echa.europa.eu/registration-dossier/-/registered-dossier/3625

2,6-Dichlorothiophenol: Does not have an individual approval but may be used under an appropriate group standard

安全データ

wgk
3
ridadr
UN 2811 6.1/PG 3
毒性
LD50 orally in Rabbit: 2400 mg/kg
hs_code
29309090
risk_code
20/21/22-36/37/38
hazard_code
Xn,Xi

化学と産業

応用分野

用途有機合成原料。

上流・下流製品情報

サプライヤー100 社

国药集团化学试剂有限公司86-21-63210123 · [email protected]
梯希爱(上海)化成工业发展有限公司021-67121386 · [email protected]
苏州道澜生物医药科技有限公司15952404857 · [email protected]
上海凌富药物研究有限公司+86(21)5895 0110 19945755304 · [email protected]
上海麦克林生化科技股份有限公司021-50706066 15221275939 · [email protected]

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