chlorobis(propan-2-yl)phosphane

• ChemBase ID: 148928
• Molecular Formular: C6H14ClP
• Molecular Mass: 152.602121
• Monoisotopic Mass: 152.05216476
• SMILES: CC(C)P(C(C)C)Cl
• Canonical SMILES: CC(P(C(C)C)Cl)C
• InChI: InChI=1S/C6H14ClP/c1-5(2)8(7)6(3)4/h5-6H,1-4H3
• InChIKey: JZPDBTOWHLZQFC-UHFFFAOYSA-N

NAMES AND DATABASE IDS

Names

• IUPAC name: chlorobis(propan-2-yl)phosphane
• IUPAC Traditional name: chlorodiisopropylphosphane
• Synonyms: Chlorodiisopropylphosphine; Chlorodiisopropylphosphine; 氯二异丙基膦

Database IDs

• CAS Number: 40244-90-4
• MDL Number: MFCD00015027
• PubChem SID: 24860498; 162243098
• PubChem CID: 538967

CALCULATED PROPERTIES

• H Acceptors: 0
• H Donor: 0
• LogD (pH = 5.5): 2.3570592
• LogD (pH = 7.4): 2.3570995
• Log P: 2.3571
• Molar Refractivity: 41.1201 cm^3
• Polarizability: 16.317928 Å^3
• Polar Surface Area: 0.0 Å^2
• Rotatable Bonds: 2
• Lipinski's Rule of Five: true

PROPERTIES

Physical Property

• Boiling Point: 69 °C/33 mmHg(lit.)
• Flash Point: 39.2 °F; 4 °C
• Density: 0.959 g/mL at 25 °C(lit.)
• Refractive Index: n20/D 1.475(lit.)
• Ligand For: Arylations

Safety Information

• European Hazard Symbols: Corrosive (C); Flammable (F)
• UN Number: 2924
• German water hazard class: 3
• Hazard Class: 3
• Packing Group: 2
• Risk Statements: 11-34
• Safety Statements: 16-26-27-36/37/39-45
• GHS Pictograms: GHS02; GHS05
• GHS Signal Word: Danger
• GHS Hazard statements: H225-H314
• GHS Precautionary statements: P210-P280-P305 + P351 + P338-P310
• Personal Protective Equipment: Faceshields, full-face respirator (US), Gloves, Goggles, multi-purpose combination respirator cartridge (US), type ABEK (EN14387) respirator filter
• RID/ADR: UN 2924 3/PG 2

Product Information

• Purity: 95+%; 96%
• Linear Formula: [(CH3)2CH]2PCl

DETAILS

Sigma Aldrich - 337773

Packaging
25 g in Sure/Seal™
5 g in glass bottle