L-p-Menth-3-yloxyessigsure
2-[[(1R,2S,5R)-5-Methyl-2-(1-methylethyl)cyclohexyl]oxy]acetic acid
Grundinformationen
- CAS
40248-63-3- Standard-SMILES
CC(C)[C@@H]1CC[C@@H](C)C[C@H]1OCC(=O)O- InChIKey
CILPHQCEVYJUDN-OUAUKWLOSA-N- Summenformel
- C12H22O3
- Durchschnittliche Molmasse
- 214,3 g/mol
Namen und Bezeichner
- Bevorzugter Name
- 2-[[(1R,2S,5R)-5-Methyl-2-(1-methylethyl)cyclohexyl]oxy]acetic acid
- IUPAC
- 2-[(1R,2S,5R)-5-methyl-2-propan-2-ylcyclohexyl]oxyacetic acid
- Lokaler Name
- L-p-Menth-3-yloxyessigsure
- Englischer Name
- (-)-Menthoxyacetic acid
- Summenformel
- C12H22O3
- Molmasse
- 214.3
Namen und Synonyme
2-[[(1R,2S,5R)-5-Methyl-2-(1-methylethyl)cyclohexyl]oxy]acetic acid2-(((1R,2S,5R)-5-Methyl-2-(1-methylethyl)cyclohexyl)oxy)acetic acidRefChem:446707(-)-Menthyloxyacetic acid40248-63-3(-)-Menthoxyacetic acidMFCD000014836070-21-9rel-2-(((1R,2S,5R)-2-Isopropyl-5-methylcyclohexyl)oxy)acetic acidSY0058332-{[(1R,2S,5R)-5-methyl-2-(propan-2-yl)cyclohexyl]oxy}acetic acidAcetic acid, [[(1R,2S,5R)-5-methyl-2-(1-methylethyl)cyclohexyl]oxy]-
Weitere Namen anzeigen
L-MENTHOXYACETIC ACID(-)-MenthyloxyaceticAci(?)-Menthyloxyacetic acidL-(Menthyloxy)acetic acidL-p-menth-3-yloxyacetic acid(-)-MENTHOXYACETIC ACID 98+%(-)-Menthyloxyacetic acid 98%(-)-menthyl carboxymethyl ether
SCHEMBL5825056DTXSID50871388CILPHQCEVYJUDN-OUAUKWLOSA-N(-)-Menthyloxyacetic acid, 98%AKOS028109457HY-W093149AS-31224CS-0140599
Datenbank-Bezeichner
- CAS
40248-63-3- PubChem CID
- 7018861
- EC Number
- 254-857-2
- Nikkaji
- J149.660C
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
- 52 · 52-55 °C(lit.)
- Siedepunkt
- 163 · 163-164 °C10 mm Hg(lit.)
- Dichte
- 1.01 g/mL · 1.01 g/mL at 20 °C(lit.)
- Brechungsindex
- 20 · n20/D 1.4672(lit.)
- Flammpunkt
- 230 °F · >230 °F
- storage temp.
- 2 · Sealed in dry,2-8°C
- Aggregatzustand
- liquid
- pka
- 3.47 · 3.47±0.10(Predicted)
- Farbe
- yellow
- BRN
- 2444474 · 2444474
- InChI
- 1S/C12H22O3/c1-8(2)10-5-4-9(3)6-11(10)15-7-12(13)14/h8-11H,4-7H2,1-3H3,(H,13,14)/t9-,10+,11-/m1/s1
- InChIKey
- CILPHQCEVYJUDN-OUAUKWLOSA-N
- SMILES
- CC(C)[C@@H]1CC[C@@H](C)C[C@H]1OCC(O)=O
- CAS Datenbank
- 40248 · 40248-63-3(CAS DataBase Reference)
Sicherheit und Regulatorisches
GHS-Klassifizierung
GHS Classification
Warning
H315 (100%): Causes skin irritation [Warning Skin corrosion/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.
Gefahrenhinweise
Hazard Classes and CategoriesSkin Irrit. 2 (100%)
Sicherheitsdaten
- wgk
- 3
- hs_code
- 29189900
- risk_code
- 36/37/38
- hazard_code
- Xi
- safety_code
- 26-36
- Speicherklasse
- 10 - Combustible liquids
- Hazard Classifications
- Eye Irrit. 2Skin Irrit. 2STOT SE 3
Chemie und Industrie
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