4-モルホリンエタンチオール

4-Morpholineethanethiol

HCID 20666
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基本情報

CAS
4542-46-5
標準SMILES
SCCN1CCOCC1
InChIKey
YZVWMFBVTTUSAW-UHFFFAOYSA-N
分子式
C6H13NOS
平均分子量
147.24 g/mol
単同位体質量
147.07178521

名称と識別子

優先名称
4-Morpholineethanethiol
IUPAC
2-morpholin-4-ylethanethiol
現地名
4-モルホリンエタンチオール
英語名
morpholin-4-ylethylthiol
分子式
C6H13NOS
分子量
147.24

名称と別名

4542-46-54-Morpholineethanethiol2-Morpholinoethanethiol2-(4-Morpholinyl)ethanethiolMorpholine, 4-mercaptoethyl-N-MorpholylcysteaminN-Morpholylcysteamin [German]4-(2-Mercaptoethyl)morpholineETHANETHIOL, MORPHOLINO-BRN 0104376EINECS 224-893-34-Morpholinethanethiol
名称をさらに表示
2-モルホリノエタンチオール2-(4-モルホリニル)エタンチオール4-モルホリンエタンチオール2-morpholinoethane-1-thiol2-(morpholino)ethane-1-thiol2-(morpholin-4-yl)ethane-1-thiol
4-27-00-00106 (Beilstein Handbook Reference)Ethanethiol, 2-morpholino-DTXSID1063514RefChem:99984DTXCID0040412YZVWMFBVTTUSAW-UHFFFAOYSA-N2-(morpholin-4-yl)ethane-1-thiolMorpholin-4-ylethylthiol

データベース識別子

CAS
4542-46-5
PubChem CID
20666
DTXSID
DTXSID1063514
EC Number
224-893-3
Nikkaji
J297.807E

物性

構造計算による物性

XLogP
0.2
極性表面積
13.5 Ų
水素結合供与体数
1
水素結合受容体数
3
回転可能結合数
2
重原子数
9

物理化学的性質

沸点
110.5 °C · 110.5°C
比重(密度)
1.017 · 1.017 (estimate)
屈折率
1.55 · 1.5500 (estimate)
酸解離定数(Pka)
10.17 · 10.17±0.10(Predicted)
EPAの化学物質情報
4 · 4-Morpholineethanethiol (4542-46-5)

安全と法規制

GHS分類

GHS Classification · 5 件

Warning

H302 (100%): Harmful if swallowed [Warning Acute toxicity, oral]；H312 (100%): 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 (100%): 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 2 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.

危険有害性情報

Hazard Classes and CategoriesAcute Tox. 4 (100%)；Acute Tox. 4 (100%)；Skin Irrit. 2 (100%)；Eye Irrit. 2A (100%)；Acute Tox. 4 (100%)；STOT SE 3 (100%)

安全データ

tsca
TSCA listed

化学と産業

用途と製造

General Manufacturing Information4-Morpholineethanethiol: INACTIVE

サプライヤー9 社

杭州摩库生物医药科技有限公司+86-057181025280; +8617767106207 · [email protected]
Aladdin Scientific[email protected]
山东李比希生物医药科技有限公司15318973357; 15318973357 · [email protected]
R&D Scientific Inc.+1-2266000236 · [email protected]
上海阿拉丁生化科技股份有限公司6206333 13167063860 · [email protected]

関連反応

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