チオフェン-2-カルボチオアミド

2-Thiophenecarbothioamide

HCID 737237CAS 20300-02-1

基本情報

標準SMILES
NC(=S)c1cccs1
InChIKey
HDXYHAPUCGQOBX-UHFFFAOYSA-N
分子式
C5H5NS2
平均分子量
143.2 g/mol
単同位体質量
142.98634151

名称と識別子

優先名称
2-Thiophenecarbothioamide
IUPAC
thiophene-2-carbothioamide
現地名
チオフェン-2-カルボチオアミド
英語名
Thiophene-2-thiocarboxamide
分子式
C5H5NS2
分子量
143.23

名称と別名

thiophene-2-carbothioamide20300-02-12-ThiophenecarbothioamideDTXSID50353210RefChem:483768DTXCID60304273641-315-9thiophene-2-thiocarboxamideThiophen-2-carbothioamideMFCD00052890Thiophene-2-carbothioic acid amidethiophene-2-thioamide
名称をさらに表示
チオフェン-2-カルボチオアミドチオフェン-2-カルボチオ酸アミドチオフェン-2-チオカルボオキサミドチオフェン-2-チオカルボキサミド2-チオフェンカルボチオアミドOTAVA-BB BB70203313112-Thiocarbamoylthiophene2-ThienylthiocarboxamideThiophen-2-thiocarboxamid2-Thiophenethiocarboxamide
(thien-2-yl)thiocarboxamidethiophen-2-carbothioic acid amideHMS1768N15Thiophene-2-carbothioamide, AldrichCPREN300-07295amino-2-thienylmethane-1-thioneSMV2-thiophe

データベース識別子

CAS
20300-02-1
PubChem CID
737237
DTXSID
DTXSID50353210
ChEMBL
CHEMBL2441348
EC Number
641-315-9
Nikkaji
J526.384K

物性

構造計算による物性

XLogP
1.3
極性表面積
86.4 Ų
水素結合供与体数
1
水素結合受容体数
2
回転可能結合数
1
重原子数
8

物理化学的性質

融点
106 °C · 106 °C
沸点
260 ℃ · 260℃
比重(密度)
1.357 · 1.357
闪点
111 ℃ · 111℃
貯蔵温度
2 · 2-8°C(protect from light)
外見
powder to crystal

安全と法規制

GHS分類

GHS Classification · 5 件

Danger

H301 (75%): Toxic if swallowed [Danger Acute toxicity, oral];H311 (16.7%): Toxic in contact with skin [Danger Acute toxicity, dermal];H315 (75%): Causes skin irritation [Warning Skin corrosion/irritation];H319 (75%): Causes serious eye irritation [Warning Serious eye damage/eye irritation];H331 (16.7%): Toxic if inhaled [Danger Acute toxicity, inhalation];H335 (66.7%): May cause respiratory irritation [Warning Specific target organ toxicity, single exposure; Respiratory tract irritation]

P261, P262, P264, P264+P265, P270, P271, P280, P301+P316, P302+P352, P304+P340, P305+P351+P338, P316, P319, P321, P330, P332+P317, P337+P317, P361+P364, P362+P364, P403+P233, P405, and P501 (click each P-code to see the statement)

Aggregated GHS information provided per 12 reports by companies from 9 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. 3 (75%);Acute Tox. 3 (16.7%);Skin Irrit. 2 (75%);Eye Irrit. 2A (75%);Acute Tox. 3 (16.7%);STOT SE 3 (66.7%)

安全データ

wgk
WGK 3
ridadr
2811
hs_code
2934999090
risk_code
25-43
hazard_code
Xi
hazard_note
Irritant

化学と産業

応用分野

使用Thiophene-2-thiocarboxamide is used as a pharmaceutical intermediate.

サプライヤー50 社

南京波普生物医药研发有限公司025-87138562 18951783565 · [email protected]
上海康恩博医药科技有限公司17510465506 · [email protected]
北京福源坊科技有限公司010-57903446 15869909019 · [email protected]
Changzhou Carman Chemical Co., Ltd.15061933924
毕佳索(上海毕得医药科技股份有限公司)400-6005915 · [email protected]

関連反応

14 件

関連ノート

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