2,2'-Azobis(2-methylpropion-amidin)dihydrochlorid

2,2'-Azobis(2-methylpropanimidamide) dihydrochloride

HCID 76344CAS 2997-92-4

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Grundinformationen

Standard-SMILES: CC(C)(N=NC(C)(C)C(=N)N)C(=N)N.Cl.Cl
InChIKey: LXEKPEMOWBOYRF-UHFFFAOYSA-N
Summenformel: C8H18N6.2ClH
Durchschnittliche Molmasse: 271,19 g/mol
Monoisotopische Masse: 270,11265

Überblick

AAPH is a monoazo compound.

Namen und Bezeichner

Bevorzugter Name: 2,2'-Azobis(2-methylpropanimidamide) dihydrochloride
IUPAC: 2-[(1-amino-1-imino-2-methylpropan-2-yl)diazenyl]-2-methylpropanimidamide;dihydrochloride
Lokaler Name: 2,2'-Azobis(2-methylpropion-amidin)dihydrochlorid
Englischer Name: 2,2′-Azobis(2-methylpropionamidine) dihydrochloride
Summenformel: C8H20Cl2N6
Molmasse: 271.19

Namen und Synonyme

2997-92-42,2'-Azobis(2-methylpropionamidine) dihydrochloride2,2'-Azodiisobutyramidine DihydrochloridePropanimidamide, 2,2'-azobis[2-methyl-, dihydrochloride2,2'-Azobis(2-methylpropanimidamide) dihydrochlorideWAKO V-50Propanimidamide, 2,2'-azobis(2-methyl-, dihydrochlorideAzobisisobutyramidinium dichloride2,2'-Azobisisobutyramidinium chlorideAzobis(isobutyramidine) dihydrochloride2,2'-Azobisamidinopropane dihydrochloride2,2'-Azobis(isobutyramidine hydrochloride)

Weitere Namen anzeigen

v50AAPHAIBAProclin2,2'-AZOBIS(2-AMIDINOPROPANE) DIHYDROCHLORIDE2,2'-AZOBIS(2-METHYLPROPIONAMIDINE)ABAPazobis-2-methyl-propanimidamide2,2’-azobis(2-methyl-propanimidamiddihydrochloride

AZOBIS(ISOBUTYL)AMIDINE HYDROCHLORIDE2,2'-azobis(isobutyramidine) dihydrochloride2,2-Azobis(2-amidinopropane) dihydrochlorideNSC-6684162,2'-AZODIISOBUTYLAMIDINE DIHYDROCHLORIDE2,2'-azobis[2-methylpropionamidine] dihydrochloride2,2'-Azobis(propane-2-carboxamidine) dihydrochloridePropanimidamide, 2,2'-(1,2-diazenediyl)bis(2-methyl-, hydrochloride (1:2)

Datenbank-Bezeichner

CAS: 2997-92-4
PubChem CID: 76344
DTXSID: DTXSID3049756
ChEMBL: CHEMBL1528605
ChEBI: CHEBI:186632
UNII: 7381JDR72F
EC Number: 221-070-0

Eigenschaften

Berechnete Struktureigenschaften

Polarare Oberfläche (TPSA): 124 Å²
H-Brücken-Donoren: 6
H-Brücken-Akzeptoren: 4
Frei drehbare Bindungen: 4
Schwere Atome: 16
Formalladung: 0
Komplexität: 248

Experimentelle und physikochemische Eigenschaften

Physical DescriptionLarge Crystals

Physikochemische Eigenschaften

Schmelzpunkt: 175 · 175-177 °C(lit.)
Dichte: 0.42 · 0.42
Dampfdruck: 0 Pa · 0Pa at 20℃
storage temp.: 0 · 0-6°C
Löslichkeit: acetone, dioxane, methanol, ethanol, DMSO and water: soluble
Aggregatzustand: granular
Farbe: White to off-white
Wasserlöslichkeit: 176.2 g/L · 176.2g/L at 20℃
Stabilität: Unstable. Sensitive to heat and light. Incompatible with strong oxidizing agents, strong acids.
InChI: InChI=1S/C8H18N6.2ClH/c1-7(2,5(9)10)13-14-8(3,4)6(11)12;;/h1-4H3,(H3,9,10)(H3,11,12);2*1H/b14-13+;;
InChIKey: LXEKPEMOWBOYRF-QDBORUFSSA-N
SMILES: C(C)(C)(/N=N/C(C)(C)C(=N)N)C(=N)N.Cl.Cl
LogP: 0.3 at · 0.3 at 25℃
CAS Datenbank: 2997 · 2997-92-4(CAS DataBase Reference)
EPA chemische Informationen: 2 · Propanimidamide, 2,2'-azobis[2-methyl-, dihydrochloride (2997-92-4)

Sicherheit und Regulatorisches

GHS-Klassifizierung

GHS Classification · 6 Einträge

Warning

H302: Harmful if swallowed [Warning Acute toxicity, oral]

P261, P264, P270, P272, P280, P301+P317, P302+P352, P321, P330, P333+P317, P362+P364, and P501 (click each P-code to see the statement)

Danger

H242 (24%): Heating may cause a fire [Danger Self-reactive substances and mixtures; Organic peroxides]

P210, P234, P235, P240, P261, P264, P270, P272, P280, P301+P317, P302+P352, P321, P330, P333+P317, P362+P364, P370+P378, P403, P410, P411, P420, and P501 (click each P-code to see the statement)

Gefahrenhinweise

Regulatory Information · 4 Einträge

Chemical: Propanimidamide, 2,2'-azobis[2-methyl-, dihydrochloride

Propanimidamide, 2,2'-(1,2-diazenediyl)bis[2-methyl-, hydrochloride (1:2) is listed on the EPA's Chemical Data Reporting (CDR) system. Manufacturers and importers of Propanimidamide, 2,2'-(1,2-diazenediyl)bis[2-methyl-, hydrochloride (1:2) 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: 06-07-2022 https://echa.europa.eu/registration-dossier/-/registered-dossier/11995

2,2'-Azobis[2-methylpropionamidine] dihydrochloride: Does not have an individual approval but may be used under an appropriate group standard

Other Safety InformationIMAP assessments - Propanimidamide, 2,2'-azobis[2-methyl-, dihydrochloride: Human health tier I assessment

Hazard Classes and Categories · 3 Einträge

Self-react. D (24%)

Acute toxicity - category 4

Acute Tox. 4 *

Sicherheitsdaten

F: 10-21
wgk: 1
tsca: TSCA listed
ridadr: UN 3226 4.1
hs_code: 29270000
RTECS-Nr.: UE4575500
risk_code: 22-43-5
Toxizität: LD50 oral in rat: 410mg/kg
hazard_code: Xn
safety_code: 24-37
hazard_class: 5.1
packing_group: III
Speicherklasse: 4.2 - Pyrophoric and self-heating hazardous materials
Hazard Classifications: Acute Tox. 4 OralAquatic Acute 1Aquatic Chronic 1Eye Irrit. 2Self-heat. 1Skin Sens. 1