[[5-Methyl-2-(1-methylethyl)cyclohexyl]oxy]essigsure
2-((5-Methyl-2-(1-methylethyl)cyclohexyl)oxy)acetic acid
Grundinformationen
- CAS
40248-63-3- Standard-SMILES
CC1CCC(C(C)C)C(OCC(=O)O)C1- InChIKey
CILPHQCEVYJUDN-UHFFFAOYSA-N- Summenformel
- C12H22O3
- Durchschnittliche Molmasse
- 214,3 g/mol
- Monoisotopische Masse
- 214,15689456
Namen und Bezeichner
- Bevorzugter Name
- 2-((5-Methyl-2-(1-methylethyl)cyclohexyl)oxy)acetic acid
- IUPAC
- 2-(5-methyl-2-propan-2-ylcyclohexyl)oxyacetic acid
- Lokaler Name
- [[5-Methyl-2-(1-methylethyl)cyclohexyl]oxy]essigsure
- Englischer Name
- [[(2S)-2-Isopropyl-5-methylcyclohexyl]oxy]acetic acid
- Summenformel
- C12H22O3
- Molmasse
- 214.3
Namen und Synonyme
71420-37-6((5-Methyl-2-(1-methylethyl)cyclohexyl)oxy)acetic acidRefChem:10605452-((5-Methyl-2-(1-methylethyl)cyclohexyl)oxy)acetic acid275-438-0(-)-Menthyloxyacetic acid40248-63-3(-)-Menthoxyacetic acidL-Menthoxyacetic acid2-(5-methyl-2-propan-2-ylcyclohexyl)oxyacetic acid[(2-Isopropyl-5-methylcyclohexyl)oxy]acetic acid(+)-Menthoxyacetic Acid
Weitere Namen anzeigen
[(1RANZ-C[1(S)-BENZYL-2(R)3-p-Menthoxyacetic acid2-Epoxy-3-(Boc-amino)-4-phe nylbutane[(1S)-1-(2R)-oxiranyl-2-phenylethyl]-3S)-5-ethynyl-4-Methylcyclohex-4-ene-13-diyl)bis(oxy)bis(tert-butyldiMethylsilane)3s)-3-(n-boc-amino)-1-oxirane-4-phenylbutane3-EPOXYPROPYL]-CARBAMIC ACID TERT-BUTYL ESTER
Levo-menthoxyacetic acid2-{[5-methyl-2-(propan-2-yl)cyclohexyl]oxy}acetic acidL-p-Menth-3-yloxyacetic acidmenthoxyacetic acid2-((2-Isopropyl-5-methylcyclohexyl)oxy)acetic acidEINECS 254-857-2EINECS 275-438-0EN300-25882
Eigenschaften
Berechnete Struktureigenschaften
- XLogP
- 3,2
- Polarare Oberfläche (TPSA)
- 46,5 Ų
- H-Brücken-Donoren
- 1
- H-Brücken-Akzeptoren
- 3
- Frei drehbare Bindungen
- 4
- Schwere Atome
- 15
- Formalladung
- 0
- Komplexität
- 213
Physikochemische Eigenschaften
- Schmelzpunkt
- 35 °C · 35 °C
- Siedepunkt
- 171 °C · 171 °C(Press: 11 Torr)
- Dichte
- 1.01 · 1.01±0.1 g/cm3(Predicted)
- pka
- 3.47 · 3.47±0.10(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
Warning
H315 (100%): Causes skin irritation [Warning Skin corrosion/irritation]；H319 (100%): Causes serious eye irritation [Warning Serious eye damage/eye irritation]；H335 (97.6%): May cause respiratory irritation [Warning Specific target organ toxicity, single exposure; Respiratory tract irritation]
P261, P264, P264+P265, P271, P280, P302+P352, P304+P340, P305+P351+P338, P319, P321, P332+P317, P337+P317, P362+P364, P403+P233, P405, and P501 (click each P-code to see the statement)
Aggregated GHS information provided per 41 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.
Gefahrenhinweise
Hazard Classes and Categories
Skin Irrit. 2 (100%)；Eye Irrit. 2 (100%)；STOT SE 3 (97.6%)
Acute Tox. 4 (100%)；Skin Irrit. 2 (100%)；Eye Irrit. 2A (100%)；STOT SE 3 (100%)
Chemie und Industrie
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