4,4'-Diamino-diphenyl-methan

4,4-Diaminodiphenylmethane

HCID 7577CAS 101-77-9

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Grundinformationen

Standard-SMILES: Nc1ccc(Cc2ccc(N)cc2)cc1
InChIKey: YBRVSVVVWCFQMG-UHFFFAOYSA-N
Summenformel: C13H14N2
Durchschnittliche Molmasse: 198,26 g/mol
Monoisotopische Masse: 198,11569846

Namen und Bezeichner

Bevorzugter Name: 4,4-Diaminodiphenylmethane
IUPAC: 4-[(4-aminophenyl)methyl]aniline
Lokaler Name: 4,4'-Diamino-diphenyl-methan
Englischer Name: 4,4'-Methylenedianiline
Summenformel: C13H14N2
Molmasse: 198.26

Namen und Synonyme

4,4'-Methylenedianiline101-77-94,4'-DIAMINODIPHENYLMETHANEDadpmMethylenedianiline4-[(4-aminophenyl)methyl]anilineBis(4-aminophenyl)methaneDianilinemethaneDianilinomethanep,p'-MethylenedianilineEpicure DDMEpikure DDM

Weitere Namen anzeigen

Diaminodiphenylmethane4,4-METHYLENEDIANILINEMDA-100Bis-(4-aMinoRubber antioxidant

Curithane4-(4-Aminobenzyl)anilineBenzenamine, 4,4'-methylenebis-Jeffamine AP-20p,p'-DiaminodiphenylmethaneSumicure M4,4'-DiphenylmethanediamineAncamine TL

Datenbank-Bezeichner

CAS: 101-77-9、1219795-26-2
PubChem CID: 7577
DTXSID: DTXSID6022422
ChEMBL: CHEMBL85728
ChEBI: CHEBI:32506
UNII: GG5LL7OBZC
EC Number: 202-974-4、663-410-4
Nikkaji: J4.995F

Eigenschaften

Berechnete Struktureigenschaften

XLogP: 1,6
Polarare Oberfläche (TPSA): 52 Å²
H-Brücken-Donoren: 2
H-Brücken-Akzeptoren: 2
Frei drehbare Bindungen: 2
Schwere Atome: 15
Formalladung: 0
Komplexität: 157

Physikochemische Eigenschaften

Schmelzpunkt: 89 · 89-91 °C(lit.)
Siedepunkt: 242 °C2 · 242 °C2 mm Hg(lit.)
Dichte: 1.15 · 1.15
Dampfdruck: 0 Pa · 0Pa at 25℃
Brechungsindex: 1.5014 · 1.5014 (estimate)
Flammpunkt: 430 °F · 430 °F
Löslichkeit: water: soluble
pka: 5.32 · 5.32±0.25(Predicted)
Farbe: White to Light yellow
Wasserlöslichkeit: 0.1 g/100 · Slightly soluble. <0.1 g/100 mL at 19 ºC
Spezifische Wärmekapazität: 1.37 J/ · Cp(crystal): 1.37 J/(g·K), at 25℃
Merck: 14 · 14,2980
BRN: 474706 · 474706
Henry's Law Constant: 1.9 · 1.9×105 mol/(m3Pa) at 25℃, HSDB (2015)
InChI: 1S/C13H14N2/c14-12-5-1-10(2-6-12)9-11-3-7-13(15)8-4-11/h1-8H,9,14-15H2
InChIKey: YBRVSVVVWCFQMG-UHFFFAOYSA-N
SMILES: Nc1ccc(Cc2ccc(N)cc2)cc1
LogP: 1.55 at · 1.55 at 25℃
CAS Datenbank: 101 · 101-77-9(CAS DataBase Reference)
NIST chemische Informationen: 4 · Benzenamine, 4,4'-methylenebis-(101-77-9)
EPA chemische Informationen: 4 · 4,4'-Methylenedianiline (101-77-9)

Sicherheit und Regulatorisches

Sicherheitsdaten

wgk: 3
tsca: TSCA listed
ridadr: UN 2651
hs_code: 29215900
RTECS-Nr.: BY5425000
risk_code: 45-39/23/24/25-43-48/20/21/22-51/53-68
Toxizität: LD50 oral in rabbit: 620mg/kg
hazard_code: T,N
safety_code: 53-45-61
hazard_class: 6.1
packing_group: III
Speicherklasse: 6.1C - Combustible acute toxic Cat.3toxic compounds or compounds which causing chronic effects
Giftige Stoffe Daten: 101-77-9(Hazardous Substances Data)
Hazard Classifications: Acute Tox. 3 OralAquatic Acute 1Aquatic Chronic 2Carc. 1BMuta. 2Skin Sens. 1STOT RE 2STOT SE 1

Chemie und Industrie

Anwendungen · 2 Einträge

Beschreibung4,4'-Methylenedianiline is an industrial chemical that is not known to occur naturally. It is also commonly known as diaminodiphenylmethane or MDA. It occurs as a colorless to pale yellow solid and has a faint odor. 4,4'-Methylenedianiline is used mainly for making polyurethane foams, which have a variety of uses, such as insulating materials in mailing containers. It is also used for making coating materials, glues, Spandex fiber, dyes, and rubber. 4,4'-Methylenedianiline is also a by-product of azo dyes. It is also possibly formed by hydrolysis of diphenylmethane-4A'-diisocyanate.

Verwenden4,4'-methylenedianiline be used as organic intermediates. Mainly used for the synthesis of polyimide and as curing agent of epoxy resin.

Vor- und nachgelagerte Produkte

Vorgelagerte Rohstoffe

Nachgelagerte Produkte

photosensitive polyimide/SiO2 hybrid mate materials (E)-1-[Bis(4-fluorphenyl)methyl]-4-cinnamylpiperazindihydrochlorid 2,2'-Methylendianilin α-(4-aminocyclohexyl)-ptoluidin Diphenylmethane-4,4'-dicarboxylic acid 2,4'-Methylendianilin 4,4'-Methylenebis(N,N-diglycidylaniline)4,4'-(4-Iminocyclohexa-2,5-dienylidenmethylen)dianilinhydrochlorid Acid Blue 127:1

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Ergänzende Hinweise · 1 Eintrag

DefinitionChEBI: 4,4'-Methylenedianiline is an aromatic amine that is diphenylmethane substituted at the 4-position of each benzene ring by an amino group. It is primarily used in industry as a chemical intermediate in the production of 4,4-methylenedianiline diisocyanates and polyisocyanates.