Glutaryldichlorid

Pentanedioyl dichloride

HCID 17887CAS 2873-74-7

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Grundinformationen

Standard-SMILES: O=C(Cl)CCCC(=O)Cl
InChIKey: YVOFTMXWTWHRBH-UHFFFAOYSA-N
Summenformel: C5H6Cl2O2
Durchschnittliche Molmasse: 169 g/mol
Monoisotopische Masse: 167,97448479

Namen und Bezeichner

Bevorzugter Name: Pentanedioyl dichloride
IUPAC: pentanedioyl dichloride
Lokaler Name: Glutaryldichlorid
Englischer Name: GLUTARYL DICHLORIDE
Summenformel: C5H6Cl2O2
Molmasse: 169.01

Namen und Synonyme

GLUTARYL CHLORIDEGlutaryl dichloridePentanedioyl dichloride2873-74-7Glutaroyl dichlorideGlutaric acid dichlorideGlutaroyl chlorideGlutaryldichloride1,3-Bis(chlorocarbonyl)propaneEINECS 220-711-1MFCD00000755NSC 519867

Weitere Namen anzeigen

nsc519867Glutaryl chloridglutaroylchlorideGlutaryldichloridglutaroyldichlorideGlutarylChloride>glutaricaciddichloride

6PPM7UQR7VNSC-519867Glutaryl chloride (7CI,8CI)glutaric acid chlorideGlutaryl chloride, 97%UNII-6PPM7UQR7V1,5-Pentanedioyl chlorideSCHEMBL180666

Datenbank-Bezeichner

CAS: 2873-74-7
PubChem CID: 17887
DTXSID: DTXSID1062679
UNII: 6PPM7UQR7V
EC Number: 220-711-1
Nikkaji: J149.591G

Eigenschaften

Berechnete Struktureigenschaften

XLogP: 1,5
Polarare Oberfläche (TPSA): 34,1 Å²
H-Brücken-Donoren: 0
H-Brücken-Akzeptoren: 2
Frei drehbare Bindungen: 4
Schwere Atome: 9
Formalladung: 0
Komplexität: 108

Experimentelle und physikochemische Eigenschaften

Chemical ClassesToxic Gases & Vapors -> Acid Halides

SpringerMaterials PropertiesBoiling point

Physical DescriptionLiquid; [Alfa Aesar MSDS]

Physikochemische Eigenschaften

Siedepunkt: 216 · 216-218 °C (lit.)
Dichte: 1.324 g/mL · 1.324 g/mL at 25 °C (lit.)
Brechungsindex: 20 · n20/D 1.472(lit.)
Flammpunkt: 224 °F · 224 °F
storage temp.: RT, protect from light, stored under nitrogen
Aggregatzustand: Liquid
Farbe: Clear colorless to yellow or red-brownish
BRN: 1363191 · 1363191
InChI: 1S/C5H6Cl2O2/c6-4(8)2-1-3-5(7)9/h1-3H2
InChIKey: YVOFTMXWTWHRBH-UHFFFAOYSA-N
SMILES: ClC(=O)CCCC(Cl)=O
CAS Datenbank: 2873 · 2873-74-7(CAS DataBase Reference)
EPA chemische Informationen: Pentanedioyl dichloride (2873-74-7)

Sicherheit und Regulatorisches

GHS-Klassifizierung

GHS Classification · 4 Einträge

Danger

H301 (90.9%): Toxic if swallowed [Danger Acute toxicity, oral]

P260, P264, P270, P280, P301+P316, P301+P330+P331, P302+P361+P354, P304+P340, P305+P354+P338, P316, P321, P330, P363, P405, and P501 (click each P-code to see the statement)

Aggregated GHS information provided per 44 reports by companies from 3 notifications to the ECHA C&L Inventory. Each notification may be associated with multiple companies.

Gefahrenhinweise

Hazards Summary · 1 Eintrag

Causes somnolence and respiratory depression in oral lethal-dose studies of rats (LD50 = 190 uL/kg); [RTECS] Reacts violently with water; Causes burns and lachrymation; Inhalation may cause corrosive injuries to upper respiratory tract and lungs; Harmful by ingestion; [Alfa Aesar MSDS]

Hazard Classes and CategoriesAcute Tox. 3 (90.9%)

Toxikologische Informationen

Adverse EffectsDermatotoxin - Skin burns.

Sicherheitsdaten

F: 10-21
wgk: 3
tsca: TSCA listed
ridadr: UN 2922 8/PG 3
hs_code: 29171900
RTECS-Nr.: SA2583000
risk_code: 22-34
Toxizität: mouse,LD50,oral,350uL/kg (0.35mL/kg),GASTROINTESTINAL: OTHER CHANGESBEHAVIORAL: SOMNOLENCE (GENERAL DEPRESSED ACTIVITY)LIVER: OTHER CHANGES,National Technical Information Service. Vol. OTS0546489,
hazard_code: C
safety_code: 26-36/37/39-45
hazard_class: 8
packing_group: II
Speicherklasse: 6.1A - Combustible acute toxic Cat. 1 and 2very toxic hazardous materials
Hazard Classifications: Acute Tox. 3 OralSkin Corr. 1B