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Grundinformationen
- CAS
4500-58-7- Standard-SMILES
CCc1ccccc1S- InChIKey
ABROBCBIIWHVNS-UHFFFAOYSA-N- Summenformel
- C8H10S
- Durchschnittliche Molmasse
- 138,23 g/mol
- Monoisotopische Masse
- 138,05032149
Namen und Bezeichner
- Bevorzugter Name
- 2-Ethylbenzenethiol
- IUPAC
- 2-ethylbenzenethiol
- Lokaler Name
- o-Ethylbenzolthiol
- Englischer Name
- 2-Ethylbenzenethiol
- Summenformel
- C8H10S
- Molmasse
- 138.23
Namen und Synonyme
2-Ethylbenzenethiol2-Ethylthiophenol4500-58-7Benzenethiol, 2-ethyl-o-Ethylbenzenethiol2-ethylbenzene-1-thiolBenzenethiol, O-ethyl-FEMA No. 33452-EthylphenylmercaptanEthylbenzenethiol, o-UNII-62GBU45I5P62GBU45I5P
Weitere Namen anzeigen
FEMA 3345o-EthylthiophenolP-Ethyl thiophenol2-ethyl-benzenethio2-ETHYLTHIOPHENOL 98%2-Ethylthiophenol,98%2-ETHYL MERCAPTOPHENOL
2-ETHYLBENZOTHIOLEINECS 224-811-6AI3-15524DTXSID20635012-ETHYLTHIOPHENOL [FHFI]RefChem:86945DTXCID6040371ABROBCBIIWHVNS-UHFFFAOYSA-N
Datenbank-Bezeichner
- CAS
4500-58-7- PubChem CID
- 3734338
- DTXSID
DTXSID2063501- ChEBI
CHEBI:190045- UNII
- 62GBU45I5P
- EC Number
- 224-811-6
- Nikkaji
- J205.879K
Eigenschaften
Berechnete StruktureigenschaftenWird ergänzt
- XLogP
- 3
- Polarare Oberfläche (TPSA)
- 1 Ų
- H-Brücken-Donoren
- 1
- H-Brücken-Akzeptoren
- 1
- Frei drehbare Bindungen
- 1
- Schwere Atome
- 9
- Formalladung
- 0
- Komplexität
- 80
Experimentelle und physikochemische Eigenschaften
Density1.040-1.045
Solubility(in ethanol)
Boiling Point
203.00 to 205.00 °C. @ 760.00 mm Hg
203-205 °C
Refractive Index1.568-1.570
Physical Descriptioncolourless liquid with disagreeable odour
Physikochemische Eigenschaften
- Schmelzpunkt
- -30 °C · -30°C (estimate)
- Siedepunkt
- 203 · 203-205 °C (lit.)
- Dichte
- 1.025 g/mL · 1.025 g/mL at 25 °C (lit.)
- Brechungsindex
- 20 · n20/D 1.5682(lit.)
- FEMA
- 3345 · 3345 | 2-ETHYLTHIOPHENOL
- Flammpunkt
- 177 °F · 177 °F
- pka
- 6.81 · 6.81±0.43(Predicted)
Sicherheit und Regulatorisches
Sicherheitsangaben dienen nur zur Orientierung und ersetzen weder das Sicherheitsdatenblatt (SDB) des Lieferanten noch geltende Vorschriften oder eine fachliche Bewertung.
GHS-Klassifizierung
GHS Classification
This chemical does not meet GHS hazard criteria for < 0.1% (1 of 1423) of reports.
Warning
H302 (97.1%): Harmful if swallowed [Warning Acute toxicity, oral]；H319 (> 99.9%): Causes serious eye irritation [Warning Serious eye damage/eye irritation]
P264, P264+P265, P270, P280, P301+P317, P305+P351+P338, P330, P337+P317, and P501 (click each P-code to see the statement)
Aggregated GHS information provided per 1423 reports by companies from 7 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 1423 reports by companies.；There are 6 notifications provided by 1422 of 1423 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.
Gefahrenhinweise
Regulatory Information
Chemical: Benzenethiol, 2-ethyl-
Benzenethiol, 2-ethyl-: Does not have an individual approval but may be used under an appropriate group standard
Hazard Classes and CategoriesAcute Tox. 4 (97.1%)；Eye Irrit. 2 (> 99.9%)
Regulatorische Informationen
Regulatory Information
Chemical: Benzenethiol, 2-ethyl-
Benzenethiol, 2-ethyl-: Does not have an individual approval but may be used under an appropriate group standard
Chemie und Industrie
Pharmakologische Informationen
Cellular LocationsMembrane
Verwendung und Herstellung
Use Classification
Flavoring Agents -> JECFA Flavorings Index
Flavouring Agent -> FLAVOURING_AGENT -> JECFA Functional Classes
General Manufacturing InformationBenzenethiol, 2-ethyl-: ACTIVE
Anbieter96 Anbieter
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]
上海阿拉丁生化科技股份有限公司400-6206333 13167063860 · [email protected]
Shandong chuangyingchemical Co., Ltd.18853181302 · [email protected]
Hebei Zhuanglai Chemical Trading Co Ltd+86-16264648883 · [email protected]
Hebei baicao biology science and technology co., ltd+86-19131911055 17824879454 · [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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