2,5-Diaminoanisol

PARA-DIAMINOANISOLE · 2-Methoxy-1,4-diaminobenzene · 2-Methoxy-1,4-benzenediamine · 1-METHOXY-2,5-DIAMINOBENZENE · 1,4-diamino-2-methoxybenzene · 2-Methoxy-1,4-phenylenediamine · 1,4-Benzenediamine, 2-methoxy- · 2-METHOXY-PARA-PHENYLENEDIAMINE

https://huagongshe.com/de/chemical/21379

Identifikatoren & physikalische Daten

CAS No.	5307-02-8
Summenformel	C7H10N2O
Durchschnittliche Molmasse	138,17 g/mol
Monoisotopische Masse	138,07931294 g/mol
SMILES	COc1cc(N)ccc1N
InChIKey	HGUYBLVGLMAUFF-UHFFFAOYSA-N
PubChem CID	21379
EC No.	226-161-9
DTXSID	DTXSID7063766
Lokaler Name	2,5-Diaminoanisol

Chemische & physikalische Eigenschaften

XLogP	0,5
Polarare Oberfläche (TPSA)	61,3
H-Brücken-Donoren	2
H-Brücken-Akzeptoren	3
Frei drehbare Bindungen	1
Schwere Atome	10
Formalladung	0
Komplexität	108
Stoffklassen	Nitrogen Compounds -> Amines, Aromatic
Color/Form	Crystals
Decomposition	When heated to decomposition it emits toxic vapor of /nitrogen oxides/.
Schmelzpunkt	107 °C103.5 °C(Solv: benzene (71-43-2))
Dampfdruck	0.00132 [mmHg]
Other Experimental Properties	UV: 2112 (Absorption Spectra in the UV and visible Regions, Academic Press, New York) /o-Phenylenediamine, 4-methoxy/
Siedepunkt	253.57°C (rough estimate)
Dichte	1.1315 (rough estimate)
Brechungsindex	1.5780 (estimate)
Lagerbedingungen	under inert gas (nitrogen or Argon) at 2–8 °C
pKa (Säurekonstante)	5.80±0.10(Predicted)
Henry-Konstante	2.5×105 mol/(m3Pa) at 25℃, HSDB (2015)
EPA chemische Informationen	1,4-Benzenediamine, 2-methoxy- (5307-02-8)

Sicherheit & Vorschriften

GHS-Einstufung	DangerH302 (100%): Harmful if swallowed [Warning Acute toxicity, oral]P233, P260, P261, P264, P270, P271, P272, P280, P284, P301+P317, P302+P352, P304+P340, P317, P321, P330, P333+P317, P342+P316, P362+P364, P403, and P501 (click each P-code to see the statement)The GHS information provided by 1 company from 1 notification to the ECHA C&L Inventory.
Gefahrenübersicht	Reproductive effects in 8-week IP study with rats include decrease in number of pregnancies and live fetusesEmergency treatment: ParaphenylenediamineIn sensitized individuals, paraphenylenediamine may cause allergic contact dermatitis following application as a hair dye and asthma following inhalationFollowing ingestion, can cause angioneurotic edema, methemoglobinemia, acute tubular necrosis, and hepatotoxicityAn adult died after ingestion of 3 grams of p-phenylenediamineAnother adult who ingested 1800 mg developed angioneurotic edema and acute renal failure[HSDB] See p-Phenylenediamine.
Special Reports	Evidence is given supporting testing of the class of compounds phenylenediamines for their toxic effects on human health and the environment. The results of toxicity testing of 22 compounds are tabulated as are the effects for which testing is being considered for 13 compounds, and the uses or potential uses of 47 phenylenediamines.[UNITED STATES EPAPHENYLENEDIAMINESRESPONSE TO INTERAGENCY TESTING COMMITTEEFED REGIST 47(5) 973 (1982)]
TSCA-Anforderungen	Pursuant to section 8(d) of TSCA, EPA promulgated a model Health and Safety Data Reporting Rule. The section 8(d) model rule requires manufacturers, importers, and processors of listed chemical substances and mixtures to submit to EPA copies and lists of unpublished health and safety studies. 1,4-Benzenediamine, 2-methoxy- is included on this list. Effective date: 4/29/83Sunset date: 4/29/93.
Hazard Classes and Categories	Acute Tox. 4 (100%)
Entsorgungsverfahren	SRP: The most favorable course of action is to use an alternative chemical product with less inherent propensity for occupational harm/injury/toxicity or environmental contamination. Recycle any unused portion of the material for its approved use or return it to the manufacturer or supplier. Ultimate disposal of the chemical must consider: the material's impact on air quality