chlorodimethylalumane

• ChemBase ID: 136967
• Molecular Formular: C2H6AlCl
• Molecular Mass: 92.503578
• Monoisotopic Mass: 91.9973415
• SMILES: C[Al](C)Cl
• Canonical SMILES: C[Al](Cl)C
• InChI: InChI=1S/2CH3.Al.ClH/h2*1H3;;1H/q;;+1;/p-1
• InChIKey: JGHYBJVUQGTEEB-UHFFFAOYSA-M

NAMES AND DATABASE IDS

Names

• IUPAC name: chlorodimethylalumane
• IUPAC Traditional name: chlorodimethylalumane
• Synonyms: Dimethylaluminum chloride solution; Dimethylaluminum chloride; 二甲基氯化铝 溶液; 二甲基氯化铝

Database IDs

• CAS Number: 1184-58-3
• EC Number: 214-668-8
• MDL Number: MFCD00000458
• PubChem SID: 24854954; 24855559; 162231234; 24855557
• PubChem CID: 79147

CALCULATED PROPERTIES

• H Acceptors: 0
• H Donor: 0
• LogD (pH = 5.5): 2.5367
• LogD (pH = 7.4): 2.5367
• Log P: 2.5367
• Molar Refractivity: 17.6965 cm^3
• Polarizability: 8.75112 Å^3
• Polar Surface Area: 0.0 Å^2
• Rotatable Bonds: 0
• Lipinski's Rule of Five: true

PROPERTIES

Physical Property

• Melting Point: -21 °C(lit.)
• Boiling Point: 126-127 °C(lit.)
• Flash Point: -.4 °F; -1 °F; -18 °C; -23 °C; -9.4 °F
• Density: 0.701 g/mL at 25 °C; 0.996 g/mL at 25 °C(lit.)
• Vapor Pressure: 79 mmHg ( 60 °C)

Safety Information

• European Hazard Symbols: Corrosive (C); Flammable (F); Nature polluting (N)
• UN Number: 3394
• German water hazard class: 1; 2
• Hazard Class: 4.2
• Packing Group: 1
• Risk Statements: 11-14/15-17-34-48/20-51/53-62-65-67; 14/15-17-23/24/25-34; 14/15-17-34
• Safety Statements: 16-26-36/37/39-45; 26-36/37/39-43-45; 9-16-26-36/37/39-43-45
• GHS Pictograms: GHS02; GHS05; GHS07; GHS08; GHS09
• GHS Signal Word: Danger
• GHS Hazard statements: H225-H250-H260-H314; H225-H250-H304-H314-H336-H361f-H373-H411
• GHS Precautionary statements: P210-P222-P223-P231 + P232-P370 + P378-P422; P210-P222-P231-P261-P273-P422
• RID/ADR: UN 3394 4.2/PG 1

Product Information

• Purity: 97%
• Concentration: 1.0 M in hexanes
• Linear Formula: (CH3)2AlCl

DETAILS

Sigma Aldrich - 256900

Packaging
200 mL in Sure-Pac™
Recommended products
Angled septum-inlet adapter Z118206 or straight septum-inlet adapter, 6mm I.D. inlet, Z118141 or straight septum-inlet adapter, 13mm I.D. inlet, Z118192 is recommended.

Sigma Aldrich - 256897

Packaging
5, 25, 100 g in Sure-Pac™
Recommended products
Angled septum-inlet adapter Z118206 or straight septum-inlet adapter, 6mm I.D. inlet, Z118141 or straight septum-inlet adapter, 13mm I.D. inlet, Z118192 is recommended.

Sigma Aldrich - 248843

Packaging
100, 800 mL in Sure/Seal™