Grundinformationen
- Standard-SMILES
Cc1cc(Br)cc(Cl)c1N- InChIKey
DIXGIKZIIZRFKE-UHFFFAOYSA-N- Summenformel
- C7H7BrClN
- Durchschnittliche Molmasse
- 220,49 g/mol
- Monoisotopische Masse
- 218,94504
Namen und Bezeichner
- Bevorzugter Name
- 4-Bromo-2-chloro-6-methylaniline
- IUPAC
- 4-bromo-2-chloro-6-methylaniline
- Englischer Name
- 4-Bromo-2-chloro-6-methylaniline
- Summenformel
- C7H7BrClN
- Molmasse
- 220.49
Namen und Synonyme
Weitere Namen anzeigen
Datenbank-Bezeichner
- CAS
30273-42-8- PubChem CID
- 2769626
- DTXSID
DTXSID60377801- EC Number
- 627-699-0
- Nikkaji
- J307.825F
Eigenschaften
Berechnete Struktureigenschaften
- XLogP
- 2,9
- Polarare Oberfläche (TPSA)
- 26 Ų
- H-Brücken-Donoren
- 1
- H-Brücken-Akzeptoren
- 1
- Frei drehbare Bindungen
- 0
- Schwere Atome
- 10
- Formalladung
- 0
- Komplexität
- 120
Physikochemische Eigenschaften
- Schmelzpunkt
- 38 · 38-42 °C(lit.)
- Siedepunkt
- 261.8 · 261.8±35.0 °C(Predicted)
- Dichte
- 1.619 · 1.619±0.06 g/cm3(Predicted)
- Flammpunkt
- 230 °F · >230 °F
- storage temp.
- Keep in dark place,Sealed in dry,Room Temperature
- Aggregatzustand
- solid
- pka
- 1.8 · 1.80±0.10(Predicted)
- BRN
- 2717133 · 2717133
- InChI
- 1S/C7H7BrClN/c1-4-2-5(8)3-6(9)7(4)10/h2-3H,10H2,1H3
- InChIKey
- DIXGIKZIIZRFKE-UHFFFAOYSA-N
- SMILES
- Cc1cc(Br)cc(Cl)c1N
Sicherheit und Regulatorisches
GHS-Klassifizierung
GHS Classification
Danger
H302 (15.2%): Harmful if swallowed [Warning Acute toxicity, oral];H312 (13%): Harmful in contact with skin [Warning Acute toxicity, dermal];H315 (87%): Causes skin irritation [Warning Skin corrosion/irritation];H317 (84.8%): May cause an allergic skin reaction [Warning Sensitization, Skin];H319 (89.1%): Causes serious eye irritation [Warning Serious eye damage/eye irritation];H332 (13%): Harmful if inhaled [Warning Acute toxicity, inhalation];H334 (84.8%): May cause allergy or asthma symptoms or breathing difficulties if inhaled [Danger Sensitization, respiratory];H335 (87%): May cause respiratory irritation [Warning Specific target organ toxicity, single exposure; Respiratory tract irritation];H373 (13%): May causes damage to organs through prolonged or repeated exposure [Warning Specific target organ toxicity, repeated exposure]
P233, P260, P261, P264, P264+P265, P270, P271, P272, P280, P284, P301+P317, P302+P352, P304+P340, P305+P351+P338, P317, P319, P321, P330, P332+P317, P333+P317, P337+P317, P342+P316, P362+P364, P403, P403+P233, P405, and P501 (click each P-code to see the statement)
Aggregated GHS information provided per 46 reports by companies from 6 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
Sicherheitsdaten
- wgk
- 3
- ridadr
- UN2811
- risk_code
- 36/37/38-42/43
- hazard_code
- Xn
- safety_code
- 26-36/37-45
- hazard_class
- 6.1
- packing_group
- III
- Speicherklasse
- 11 - Combustible Solids
- Hazard Classifications
- Eye Irrit. 2Resp. Sens. 1Skin Irrit. 2Skin Sens. 1STOT SE 3
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