Grundinformationen
- Standard-SMILES
CC(=O)Nc1ccc(N)cc1- InChIKey
CHMBIJAOCISYEW-UHFFFAOYSA-N- Summenformel
- C8H10N2O
- Durchschnittliche Molmasse
- 150,18 g/mol
- Monoisotopische Masse
- 150,07931294
Überblick
P-aminoacetanilide appears as white or slightly reddish solid. (NTP, 1992)
Namen und Bezeichner
- Bevorzugter Name
- 4-Aminoacetanilide
- IUPAC
- N-(4-aminophenyl)acetamide
- Lokaler Name
- 4'-Aminoacetanilid
- Englischer Name
- 4'-Aminoacetanilide
- Summenformel
- C8H10N2O
- Molmasse
- 150.18
Namen und Synonyme
Weitere Namen anzeigen
Datenbank-Bezeichner
- CAS
122-80-5- PubChem CID
- 31230
- DTXSID
DTXSID7024455- ChEMBL
CHEMBL1318876- ChEBI
CHEBI:229632- UNII
- IH5OX0I3Z9
- EC Number
- 204-576-6
- Nikkaji
- J43.352G
Eigenschaften
Berechnete Struktureigenschaften
- XLogP
- 0,1
- Polarare Oberfläche (TPSA)
- 55,1 Ų
- H-Brücken-Donoren
- 2
- H-Brücken-Akzeptoren
- 2
- Frei drehbare Bindungen
- 1
- Schwere Atome
- 11
- Formalladung
- 0
- Komplexität
- 139
Experimentelle und physikochemische Eigenschaften
Physical Description
P-aminoacetanilide appears as white or slightly reddish solid. (NTP, 1992)
White or slightly reddish solid; Darkened by air; [Merck Index] Brown solid; [Acros Organics MSDS]
Physikochemische Eigenschaften
- Schmelzpunkt
- 164 · 164-167 °C(lit.)
- Siedepunkt
- 267 °C · 267 °C
- Dichte
- 1.1392 · 1.1392 (rough estimate)
- Brechungsindex
- 1.618 · 1.6180 (estimate)
- Flammpunkt
- 195 °C · 195°C
- storage temp.
- 30 °C · Store below +30°C.
- Löslichkeit
- 65 g/l · 65g/l slightly soluble
- Aggregatzustand
- Fine Crystalline Powder
- pka
- 14.75 · 14.75±0.70(Predicted)
- Farbe
- Pink to brown
- PH
- 7.2 · 7.2 (1g/l, H2O, 20℃)
- Wasserlöslichkeit
- 0.1 · 0.1-1 g/100 mL at 25 ºC
- Merck
- 14 · 14,411
- BRN
- 742888 · 742888
- InChI
- 1S/C8H10N2O/c1-6(11)10-8-4-2-7(9)3-5-8/h2-5H,9H2,1H3,(H,10,11)
- InChIKey
- CHMBIJAOCISYEW-UHFFFAOYSA-N
- SMILES
- CC(=O)Nc1ccc(N)cc1
- CAS Datenbank
- 122 · 122-80-5(CAS DataBase Reference)
- NIST chemische Informationen
- Acetamide, N-(4-aminophenyl)-(122-80-5)
- EPA chemische Informationen
- 4 · 4'-Aminoacetanilide (122-80-5)
Sicherheit und Regulatorisches
GHS-Klassifizierung
GHS Classification
This chemical does not meet GHS hazard criteria for 4.5% (8 of 179) of reports.
Danger
H317 (88.3%): May cause an allergic skin reaction [Warning Sensitization, Skin]
P233, P260, P261, P264+P265, P271, P272, P280, P284, P302+P352, P304+P340, P305+P351+P338, P321, P333+P317, P337+P317, P342+P316, P362+P364, P403, and P501 (click each P-code to see the statement)
Aggregated GHS information provided per 179 reports by companies from 11 notifications to the ECHA C&L Inventory. Each notification may be associated with multiple companies.
Gefahrenhinweise
Regulatory Information
Chemical: Acetamide, N-(4-aminophenyl)-
Acetamide, N-(4-aminophenyl)- is listed on the EPA's Chemical Data Reporting (CDR) system. Manufacturers and importers of Acetamide, N-(4-aminophenyl)- are required to report information about their production and use of this chemical to the EPA under the Toxic Substances Control Act (TSCA). (40 eCFR Part 711)
Status: Active Update: 22-03-2018 https://echa.europa.eu/registration-dossier/-/registered-dossier/23567
Reactivity Profile
Aromatic amines are chemical bases. They neutralize acids to form salts plus water. These acid-base reactions are exothermic. The amount of heat that is evolved per mole of amine in a neutralization is largely independent of the strength of the amine as a base. Amines may be incompatible with isocyanates, halogenated organics, peroxides, phenols (acidic), epoxides, anhydrides, and acid halides. Flammable gaseous hydrogen is generated by amines 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: Should a spill occur while you are handling this chemical, FIRST REMOVE ALL SOURCES OF IGNITION, then you should dampen the solid spill material with ethanol and transfer the dampened material to a suitable container. Use absorbent paper dampened with ethanol to pick up any remaining material. Seal the absorbent paper, and any of your clothes, which may be contaminated, 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)
Sicherheitsdaten
- F
- 8-9-23
- wgk
- 1
- tsca
- TSCA listed
- hs_code
- 29242995
- RTECS-Nr.
- AD8225000
- risk_code
- 36-42/43-20/21/22-R36
- hazard_code
- Xn,Xi
- safety_code
- 22-26-36/37-39-36-S39-S26
- hazard_class
- IRRITANT
- Speicherklasse
- 11 - Combustible Solids
- Hazard Classifications
- Eye Irrit. 2
Chemie und Industrie
Verwendung und Herstellung
Anwendungen
VerwendenIntermediate in the manufacture of azo dyes, pharmaceuticals.
Vor- und nachgelagerte Produkte
Vorgelagerte Rohstoffe
Nachgelagerte Produkte
Anbieter50 Anbieter
Zugehörige Reaktionen
Verknüpfte Notizen
Wird geladen…