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4'-Aminoacetanilid

4-Aminoacetanilide

HCID 31230
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Grundinformationen

CAS
122-80-5
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

4-AMINOACETANILIDEp-Amino acetanilideDTXSID7024455DTXCID704455RefChem:8579774'-AminoacetanilideN-(4-Aminophenyl)acetamide122-80-5p-Aminoacetanilide4-AcetamidoanilineAcetparaminAcetamide, N-(4-aminophenyl)-
Weitere Namen anzeigen
PARA AMINO ACETANILIDEN-(2-Aminophenyl)acetamide4’-aminoacetanilidc.i.76005fourrineaC.I. 76005
Fourrine Ap-AcetamidoanilineN-Acetyl-p-phenylenediamineAcetyl-p-phenylenediaminep-Acetoaminoaniline4-(Acetylamino)anilineFourrine 88Acetanilide, 4'-amino-

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

Chemical ClassesNitrogen Compounds -> Other Aromatics (Nitrogen)
SpringerMaterials Properties13C nuclear magnetic resonance spectrum
LogP0.08
Solubility1 to 10 mg/mL at 77 °F (NTP, 1992)
Boiling Point513 °F at 760 mmHg (NTP, 1992)
Melting Point329 to 334 °F (NTP, 1992)
Vapor Pressure0.0000134 [mmHg]
Physical Description · 2 Einträge

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

Sicherheitsangaben dienen nur zur Orientierung und ersetzen weder das Sicherheitsdatenblatt (SDB) des Lieferanten noch geltende Vorschriften oder eine fachliche Bewertung.

GHS-Klassifizierung

GHS Classification · 5 Einträge

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 · 3 Einträge

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

Fire HazardsFlash point data are not available for this chemical, but it is probably combustible. (NTP, 1992)
Health HazardsSYMPTOMS: Symptoms of exposure to this compound may include irritation of the skin, eyes and mucous membranes.
Hazards SummaryA moderate eye irritant; [RTECS] May cause skin, eye, and mucous membrane irritation; [NTP] An eye irritant; [Acros Organics MSDS] See p-Chloroacetanilide.
Reactive GroupAmides and Imides
Reactivity Profile · 1 Eintrag

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.

Air and Water ReactionsSlightly soluble in water.
Hazard Classes and CategoriesSkin Sens. 1 (88.3%)

Sicherheit und Schutzausrüstung

Fire FightingFires involving this compound should be controlled using a dry chemical, carbon dioxide or Halon extinguisher. (NTP, 1992)
First Aid · 1 Eintrag

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 · 1 Eintrag

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) · 1 Eintrag

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

UsesUsed to make azo dyes and pharmaceuticals; [Merck Index]
U.S. Production2023: <50,000 lb
General Manufacturing InformationAcetamide, N-(4-aminophenyl)-: ACTIVE

Anwendungen

VerwendenIntermediate in the manufacture of azo dyes, pharmaceuticals.

Vor- und nachgelagerte Produkte

Vorgelagerte Rohstoffe

NitroAluminium-nickel4'-NitroacetanilidEssigsäureanhydridEisenoxidDinatriumsulfidEisenPyridinAcetanilidSchwefelsureNitroanilin (p)Acetamide, N-(4-azidophenyl)-tert-butyl 4-(acetylamino)phenylcarbamateN-[4-(1-Hydroxyethyl)phenyl]acetamide4'-ChloracetanilidN-(4-Oxocyclohexyl)acetamide4-Aminoacetophenone oxime

Nachgelagerte Produkte

4,4'-DiaminodiphenylaminsulfatDinatrium-5-acetamido-3-(4-acetamidophenyl)azo-4-hydroxynaphthalin-2,7-disulfonatDinatrium-3-[(4-acetamidophenyl)azo]-4-hydroxy-7-[[[[5-hydroxy-6-(phenylazo)-7-sulfonato-2-naphthyl]amino]carbonyl]amino]naphthalin-2-sulfonatDinatrium-2,2'-[(2,4-dihydroxy-1,3-phenylen)bis(azo-4,1-phenylenimino)]bis(5-nitrobenzolsulfonat)N-[4-[(9,10-Dihydro-4-hydroxy-9,10-dioxo-1-anthryl)amino]phenyl]acetamid2-[[4-[[4-[Bis(2-hydroxyethyl)amino]-6-chlor-1,3,5-triazin-2-yl]amino]phenyl]azo]-p-kresolTrinatrium-6-[(7-amino-1-hydroxy-3-sulfonato-2-naphthyl)azo]-3-[[4-[[4-amino-6(oder 7)-sulfonatonaphthyl]azo]phenyl]azo]-4-hydroxynaphthalin-2-sulfonat4-AcetamidoaniliniumchloridN-(4-chlorophenyl)-4-nitrobenzenesulfonamideAcid red 137C.I. Disperse Orange 66

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