基本情報
- CAS
870-73-5- 標準SMILES
CCSC(C)=S- InChIKey
KCOPWUJJPSTRIZ-UHFFFAOYSA-N- 分子式
- C4H8S2
- 平均分子量
- 120.2 g/mol
- 単同位体質量
- 120.0067426
名称と識別子
- 優先名称
- Ethyl dithioacetate
- IUPAC
- ethyl ethanedithioate
- 現地名
- ジチオ酢酸エチル
- 英語名
- Ethyl dithioacetate
- 分子式
- C4H8S2
- 分子量
- 120.24
名称と別名
Ethyl dithioacetate870-73-5ethyl ethane(dithioate)EINECS 212-801-4DTXSID00236049RefChem:596181DTXCID50158540212-801-4Ethyl ethanedithioate1-(ethylsulfanyl)ethane-1-thionedithioacetic acid ethyl esterEthyl ethanedithioate #
名称をさらに表示
ジチオ酢酸エチルエチル エタンジチオアートEthyl dithioacetate,98%Ethyl dithioacetate 98%
Ethyl dithioacetate, 98%CH3C(S)SC2H5ethanedithioic acid ethyl esterSCHEMBL20295332-amino-5-chloro-9-fluorenoneEthane(dithioic) acid, ethyl ester2-azanyl-5-chloranyl-fluoren-9-oneAKOS015898563
データベース識別子
- CAS
870-73-5- PubChem CID
- 70093
- DTXSID
DTXSID00236049- EC Number
- 212-801-4
- Nikkaji
- J195.145I
物性
構造計算による物性
- XLogP
- 1.6
- 極性表面積
- 57.4 Ų
- 水素結合供与体数
- 0
- 水素結合受容体数
- 2
- 回転可能結合数
- 2
- 重原子数
- 6
- 形式電荷
- 0
- 複雑度
- 49
物理化学的性質
- 沸点
- 61 °C/23 · 61 °C/23 mmHg (lit.)
- 比重(密度)
- 1.048 g/mL · 1.048 g/mL at 25 °C (lit.)
- 屈折率
- 20 · n20/D 1.568(lit.)
- 闪点
- 115 °F · 115 °F
- 外見
- liquid
- BRN
- 1737711 · 1737711
- InChI
- 1S/C4H8S2/c1-3-6-4(2)5/h3H2,1-2H3
- InChIKey
- KCOPWUJJPSTRIZ-UHFFFAOYSA-N
- SMILES
- CCSC(C)=S
安全と法規制
安全情報は参考情報です。供給元の安全データシート（SDS）、適用法令、専門家による評価に代わるものではありません。
GHS分類
GHS Classification
Warning
H226 (100%): Flammable liquid and vapor [Warning Flammable liquids]；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]
P210, P233, P240, P241, P242, P243, P261, P264, P264+P265, P271, P280, P302+P352, P303+P361+P353, P304+P340, P305+P351+P338, P319, P321, P332+P317, P337+P317, P362+P364, P370+P378, P403+P233, P403+P235, P405, and P501 (click each P-code to see the statement)
Aggregated GHS information provided per 40 reports by companies from 3 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 CategoriesFlam. Liq. 3 (100%)；Skin Irrit. 2 (100%)；Eye Irrit. 2 (100%)；STOT SE 3 (100%)
安全データ
- F
- 10-13-23
- wgk
- 3
- ridadr
- UN 3272 3/PG 3
- risk_code
- 10-36/37/38
- hazard_code
- Xi
- safety_code
- 26
- hazard_class
- 3.2
- packing_group
- III
- Hazard Classifications
- Eye Irrit. 2Flam. Liq. 3Skin Irrit. 2STOT SE 3
化学と産業
応用分野
使用Ethyl dithioacetate may be used in the preparation of N-thioacetylamino acids.
一般的な説明Ethyl dithioacetate is an alkyl dithioester. It reacts with 5,6-diamino-1,3-dimethyluracil to yield the purine derivative. Raman spectra of ethyl dithioacetate has been recorded as a function of temperature in the liquid phase and in the solid phase at low temperature.
上流・下流製品情報
下流製品
サプライヤー18 社
上海阿拉丁生化科技股份有限公司400-6206333 13167063860 · [email protected]
Hebei Chuanghai Biotechnology Co., Ltd+86-17732866630 · [email protected]
Dayang Chem (Hangzhou) Co.,Ltd.+86-0571-88938639 17705817739 · [email protected]
安耐吉化学&3A（安徽泽升科技股份有限公司）400-0056266 · [email protected]
天津希恩思生化科技有限公司400 638 7771 · [email protected]
PT CHEM GROUP LIMITED+86-85511178; +86-85511178 · [email protected]
上海寰川实业有限公司021-61478794 · [email protected]
関連反応
25 件
化合物ノート
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