dimethyl(phenyl)phosphane

• ChemBase ID: 127096
• Molecular Formular: C8H11P
• Molecular Mass: 138.146701
• Monoisotopic Mass: 138.05983698
• SMILES: P(c1ccccc1)(C)C
• Canonical SMILES: CP(c1ccccc1)C
• InChI: InChI=1S/C8H11P/c1-9(2)8-6-4-3-5-7-8/h3-7H,1-2H3
• InChIKey: HASCQPSFPAKVEK-UHFFFAOYSA-N

NAMES AND DATABASE IDS

Names

• IUPAC name: dimethyl(phenyl)phosphane
• IUPAC Traditional name: dimethylphenylphosphine
• Synonyms: Dimethylphenylphosphine; Dimethylphenylphosphine; Me2PPh; Phenyldimethylphosphine; Dimethylphenylphosphine; 二甲基苯基膦

Database IDs

• CAS Number: 672-66-2
• EC Number: 211-595-3
• MDL Number: MFCD00008509
• Beilstein Number: 742064
• PubChem SID: 162221419; 24856050
• PubChem CID: 69597
• CHEBI ID: 30671
• Chemspider ID: 62800
• Wikipedia Title: Dimethylphenylphosphine

CALCULATED PROPERTIES

• H Acceptors: 0
• H Donor: 0
• LogD (pH = 5.5): 2.194198
• LogD (pH = 7.4): 2.3848538
• Log P: 2.3882
• Molar Refractivity: 41.7725 cm^3
• Polarizability: 16.763628 Å^3
• Polar Surface Area: 0.0 Å^2
• Rotatable Bonds: 1
• Lipinski's Rule of Five: true

PROPERTIES

Physical Property

• Solubility: Insoluble in water
• Apperance: Colorless light pale yellow liquid
• Melting Point: N/A
• Boiling Point: 74-75 °C/12 mmHg(lit.); 74-75°C @ 12 mmHg; 75-79°C/12mm
• Flash Point: 120.2 °F; 49 °C; 49°C; 50°C(122°F)
• Density: 0.971; 0.971 g/cm^3; 0.971 g/mL at 25 °C(lit.)
• Refractive Index: 1.563; n20/D 1.563(lit.)
• Vapor Pressure: 11 mmHg ( 68 °C)

Safety Information

• Storage Warning: Air Sensitive
• European Hazard Symbols: Irritant (Xi)
• UN Number: 1993; UN1993
• German water hazard class: 3
• Hazard Class: 3
• Packing Group: 3; III
• Risk Statements: 10-36/37/38; R10 R36 R37 R38
• Safety Statements: 26-36; 26-37; S26 S36
• TSCA Listed: 否
• GHS Pictograms: GHS02; GHS07
• GHS Signal Word: Warning
• GHS Hazard statements: H226-H315-H319-H335
• GHS Precautionary statements: P210-P241-P303+P361+P353-P305+P351+P338-P405-P501A; P261-P305 + P351 + P338
• Personal Protective Equipment: Eyeshields, Faceshields, full-face respirator (US), Gloves, multi-purpose combination respirator cartridge (US), type ABEK (EN14387) respirator filter
• RID/ADR: UN 1993 3/PG 3

Product Information

• Purity: 97%; 99%
• Linear Formula: (CH3)2PC6H5

DETAILS

Sigma Aldrich - 265020

Packaging
1, 5, 25 g in ampule