trichloro(oxo)vanadium

• ChemBase ID: 130120
• Molecular Formular: Cl3OV
• Molecular Mass: 173.2999
• Monoisotopic Mass: 171.84543216
• SMILES: Cl[V](=O)(Cl)Cl
• Canonical SMILES: Cl[V](=O)(Cl)Cl
• InChI: InChI=1S/3ClH.O.V/h3*1H;;/q;;;;+3/p-3
• InChIKey: JBIQAPKSNFTACH-UHFFFAOYSA-K

NAMES AND DATABASE IDS

Names

• IUPAC name: trichloro(oxo)vanadium
• IUPAC Traditional name: trichlorooxovanadium
• Synonyms: Trichlorooxovanadium oxide; Vanadium(V) oxytrichloride; Vanadium(V) oxychloride; Vanadyl chloride; Vanadyl trichloride; Vanadium oxytrichloride; 三氯一氧化钒; 三氯代氧化钒(V); 三氯氧钒(V)

Database IDs

• CAS Number: 7727-18-6
• EC Number: 231-780-2
• MDL Number: MFCD00011459
• PubChem SID: 24855504; 162224405; 24851980
• PubChem CID: 24410
• Chemspider ID: 10613097
• MeSH Name: trichlorooxo+vanadium
• Wikipedia Title: Vanadium_oxytrichloride

CALCULATED PROPERTIES

• H Acceptors: 1
• H Donor: 0
• LogD (pH = 5.5): 1.5521
• LogD (pH = 7.4): 1.5521
• Log P: 1.5521
• Molar Refractivity: 19.8518 cm^3
• Polarizability: 10.684612 Å^3
• Polar Surface Area: 17.07 Å^2
• Rotatable Bonds: 0
• Lipinski's Rule of Five: true

PROPERTIES

Physical Property

• Solubility: Decomposes in water
• Apperance: liquid; Vivid orange, transparent liquid
• Melting Point: -76.5°C; -77 °C(lit.)
• Boiling Point: 126.7°C; 126-127 °C(lit.)
• Density: 1.826 g mL^-1; 1.84 g/mL at 25 °C(lit.)
• Vapor Pressure: 1.84 kPa (at 20 °C); 13.8 mmHg ( 20 °C)

Safety Information

• RTECS: YW2975000
• European Hazard Symbols: Toxic (T)
• UN Number: 2443
• German water hazard class: 3
• Hazard Class: 8
• Packing Group: 2
• Risk Statements: 14-25-34; R14, R25, R34
• Safety Statements: 26-27-28-36/37/39-45; S26, S27, S36/37/39, S45
• GHS Pictograms: GHS corrosion; GHS skull and crossbones; GHS05; GHS06
• GHS Signal Word: DANGER; Danger
• NFPA704:
  

  1

  3

  3
• LD50: 140 mg kg^-1 (oral, rat)
• GHS Hazard statements: 301, 314; H301-H314
• GHS Precautionary statements: 280, 301+310, 305+351+338, 310; P280-P301 + P310-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 2443 8/PG 2
• Supplemental Hazard Statements: Reacts violently with water.

Product Information

• Purity: 99%; 99.995% trace metals basis
• Linear Formula: VOCl3

DETAILS

Sigma Aldrich - 256048

Packaging
10 g in ampule

Sigma Aldrich - 200891

Packaging
100 g in Sure/Seal™