3-Methoxy-2-methylaniline
Grundinformationen
- CAS
19500-02-8- Standard-SMILES
COc1cccc(N)c1C- InChIKey
OPXLVWLFDKRYRB-UHFFFAOYSA-N- Summenformel
- C8H11NO
- Durchschnittliche Molmasse
- 137,18 g/mol
- Monoisotopische Masse
- 137,08406397
Namen und Bezeichner
- Bevorzugter Name
- 3-Methoxy-2-methylaniline
- IUPAC
- 3-methoxy-2-methylaniline
- Englischer Name
- 3-Methoxy-2-methylaniline
- Summenformel
- C8H11NO
- Molmasse
- 137.18
Namen und Synonyme
3-Methoxy-2-methylaniline19500-02-8DTXSID70473005RefChem:94568DTXCID80423819677-461-53-methoxy-2-methyl-anilineMFCD064125683-Methoxy-2-methyl-phenylamine1-Amino-3-methoxy-2-methylbenzeneBenzenamine, 3-methoxy-2-methyl-2-methyl-3-Methoxyaniline
Weitere Namen anzeigen
3-Methoxy-2-nitroaniline3-Metho3-methoxy-2-methylbenzenamine2-Nitro-m-anisidine2-Methyl-M-anisidine3-Methoxy-2-methylanili2-METHYL-3-AMINO ANISOLE3-AMINO-2-METHYL-ANISOLE2-AMino-6-Methoxytoluene
3-Methoxy-o-toluidine3-AMINO-2-METHYLANISOLE2-Methoxy6-aminotoluene2-Amino-6-methoxy-toluol2-methyl-3-methoxy aniline3-methoxy-2-methyl anilineSCHEMBL2657373-metoxy-2-methyl-phenylamine
Datenbank-Bezeichner
- CAS
19500-02-8- PubChem CID
- 11804822
- DTXSID
DTXSID70473005- EC Number
- 677-461-5
- Nikkaji
- J141.477A
Eigenschaften
Berechnete Struktureigenschaften
- XLogP
- 2,2
- Polarare Oberfläche (TPSA)
- 35,3 Ų
- H-Brücken-Donoren
- 1
- H-Brücken-Akzeptoren
- 2
- Frei drehbare Bindungen
- 1
- Schwere Atome
- 10
- Formalladung
- 0
- Komplexität
- 105
Physikochemische Eigenschaften
- Schmelzpunkt
- 27 · 27-28°C
- Siedepunkt
- 243.4 · 243.4±20.0 °C(Predicted)
- Dichte
- 1.08 · 1.08
- Brechungsindex
- 1.573 · 1.5730-1.5770
- Flammpunkt
- 110 ℃ · >110℃
- storage temp.
- Keep in dark place,Sealed in dry,Room Temperature
- Löslichkeit
- DMSO (Slightly), Methanol (Slightly)
- Aggregatzustand
- Oil
- pka
- 4.03 · 4.03±0.10(Predicted)
- Farbe
- Brown to Dark Brown
- InChI
- InChI=1S/C8H11NO/c1-6-7(9)4-3-5-8(6)10-2/h3-5H,9H2,1-2H3
- InChIKey
- OPXLVWLFDKRYRB-UHFFFAOYSA-N
- SMILES
- C1(N)=CC=CC(OC)=C1C
- CAS Datenbank
- 19500 · 19500-02-8(CAS DataBase Reference)
Sicherheit und Regulatorisches
GHS-Klassifizierung
GHS Classification
Warning
H302 (97.6%): Harmful if swallowed [Warning Acute toxicity, oral]
P264, P270, P301+P317, P330, and P501 (click each P-code to see the statement)
Aggregated GHS information provided per 41 reports by companies from 3 notifications to the ECHA C&L Inventory.
Gefahrenhinweise
Hazard Classes and CategoriesAcute Tox. 4 (97.6%)
Sicherheitsdaten
- wgk
- 1
- ridadr
- 2810
- hs_code
- 2921490090
- risk_code
- 22
- hazard_code
- Xn
- hazard_class
- 6.1
- packing_group
- III
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