Grundinformationen
- Standard-SMILES
CCOc1cccc(N)c1- InChIKey
WEZAHYDFZNTGKE-UHFFFAOYSA-N- Summenformel
- C8H11NO
- Durchschnittliche Molmasse
- 137,18 g/mol
- Monoisotopische Masse
- 137,08406397
Überblick
M-phenetidine is a dark red liquid. (NTP, 1992)
Namen und Bezeichner
- Bevorzugter Name
- 3-Ethoxyaniline
- IUPAC
- 3-ethoxyaniline
- Lokaler Name
- m-Phenetidin
- Englischer Name
- 3-Ethoxyaniline
- Summenformel
- C8H11NO
- Molmasse
- 137.18
Namen und Synonyme
Weitere Namen anzeigen
Datenbank-Bezeichner
- CAS
621-33-0- PubChem CID
- 12120
- DTXSID
DTXSID0025862- ChEMBL
CHEMBL1466168- UNII
- XE9KKL972R
- EC Number
- 210-680-2
- Nikkaji
- J101.236C
Eigenschaften
Berechnete Struktureigenschaften
- XLogP
- 1,3
- Polarare Oberfläche (TPSA)
- 35,3 Ų
- H-Brücken-Donoren
- 1
- H-Brücken-Akzeptoren
- 2
- Frei drehbare Bindungen
- 2
- Schwere Atome
- 10
- Formalladung
- 0
- Komplexität
- 95,3
Experimentelle und physikochemische Eigenschaften
Physical Description
M-phenetidine is a dark red liquid. (NTP, 1992)
Dark red liquid; [CAMEO] Clear light brown viscous liquid; [Sigma-Aldrich MSDS]
Physikochemische Eigenschaften
- Schmelzpunkt
- 204 °C · 204 °C
- Siedepunkt
- 248 °C · 248 °C(lit.)
- Dichte
- 1.032 g/mL · 1.032 g/mL at 25 °C(lit.)
- Brechungsindex
- 20 · n20/D 1.566(lit.)
- Flammpunkt
- 230 °F · >230 °F
- storage temp.
- 30 °C · Store below +30°C.
- Löslichkeit
- Chloroform, Methanol (Slightly)
- Aggregatzustand
- Liquid
- pka
- 4.18 · 4.18(at 25℃)
- Farbe
- Clear brown
- Wasserlöslichkeit
- 0.1 · 0.1-0.5 g/100 mL at 20 ºC
- BRN
- 971028 · 971028
- Stabilität
- Stable. Combustible. Incompatible with strong oxidizing agents, acids, acid chlorides, acid anhydrides. Sensitive to prolonged exposure to light and air.
- InChI
- 1S/C8H11NO/c1-2-10-8-5-3-4-7(9)6-8/h3-6H,2,9H2,1H3
- InChIKey
- WEZAHYDFZNTGKE-UHFFFAOYSA-N
- SMILES
- CCOc1cccc(N)c1
- CAS Datenbank
- 621 · 621-33-0(CAS DataBase Reference)
- NIST chemische Informationen
- 3 · 3-Ethoxyaniline(621-33-0)
- EPA chemische Informationen
- m-Ethoxyaniline (621-33-0)
Sicherheit und Regulatorisches
GHS-Klassifizierung
GHS Classification
This chemical does not meet GHS hazard criteria for 48.7% (37 of 76) of reports.
Danger
H301 (51.3%): Toxic if swallowed [Danger Acute toxicity, oral]
P260, P261, P262, P264, P270, P271, P280, P301+P316, P302+P352, P304+P340, P316, P319, P321, P330, P361+P364, P403+P233, P405, and P501 (click each P-code to see the statement)
Aggregated GHS information provided per 76 reports by companies from 3 notifications to the ECHA C&L Inventory. Each notification may be associated with multiple companies.
Gefahrenhinweise
Reactivity Profile
M-PHENETIDINE neutralizes acids in exothermic reactions to form salts plus water. May be incompatible with isocyanates, halogenated organics, peroxides, phenols (acidic), epoxides, anhydrides, and acid halides. Flammable gaseous hydrogen may be generated in combination with strong reducing agents, such as hydrides.
Sicherheit und Schutzausrüstung
First Aid
EYES: First check the victim for contact lenses and remove if present. Flush victim's eyes with water or normal saline solution for 20 to 30 minutes while simultaneously calling a hospital or poison control center. Do not put any ointments, oils, or medication in the victim's eyes without specific instructions from a physician. IMMEDIATELY transport the victim after flushing eyes to a hospital even if no symptoms (such as redness or irritation) develop.
Nonfire Spill Response
SMALL SPILLS AND LEAKAGE: If you spill this chemical, FIRST REMOVE ALL SOURCES OF IGNITION. Then, use absorbent paper to pick up all liquid spill material. Your contaminated clothing and absorbent paper should be sealed in a vapor-tight plastic bag for eventual disposal. Solvent wash all contaminated surfaces with ethanol followed by washing with a soap and water solution. Do not reenter the contaminated area until the Safety Officer (or other responsible person) has verified that the area has been properly cleaned.
Personal Protective Equipment (PPE)
RECOMMENDED RESPIRATOR: Where the neat test chemical is weighed and diluted, wear a NIOSH-approved half face respirator equipped with an organic vapor/acid gas cartridge (specific for organic vapors, HCl, acid gas and SO2) with a dust/mist filter. (NTP, 1992)
Toxikologische Informationen
Sicherheitsdaten
- F
- 8-10-23
- wgk
- 3
- tsca
- TSCA listed
- ridadr
- UN 2311 6.1/PG 3
- hs_code
- 29222200
- RTECS-Nr.
- SI5400000
- risk_code
- 23/24/25-33
- Toxizität
- mma-sat 1 mg/plate EMMUEG 11(Suppl12),1,88
- hazard_code
- T
- safety_code
- 28-36/37/39-45-36/37-28A
- hazard_class
- 6.1(b)
- packing_group
- III
- Speicherklasse
- 6.1C - Combustible acute toxic Cat.3toxic compounds or compounds which causing chronic effects
- Hazard Classifications
- Acute Tox. 3 DermalAcute Tox. 3 InhalationAcute Tox. 3 OralSTOT RE 2
Chemie und Industrie
Verwendung und Herstellung
Anwendungen
Verwenden3-Ethoxyaniline was used as starting reagent in the synthesis of 1,2,3,4-tetrahydroacridinylhydrazides.
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