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Home> Hot Product Listed V   > Vanadium chloride(VCl2) (6CI,8CI,9CI)
19774-82-4 structure

Vanadium chloride(VCl2) (6CI,8CI,9CI)

Iupac Name:(2-butyl-1-benzofuran-3-yl)-[4-[2-(diethylamino)ethoxy]-3,5-diiodophenyl]methanone;hydrochloride
CAS No.:19774-82-4
Molecular Weight:681.778
Molecular Formula:C147H239N43O42S2 (isomer)
Names and Identifiers
Synonyms

Dichlorovanadium Vanadium chloride Vanadium chloride(VCl2) (6CI,8CI,9CI) Vanadium dichloride Vanadium(II) chloride VANADIUM(II) CHLORIDE 95% Vanadium(II) dichloride

Inchi
InChI=1S/C25H29I2NO3.ClH/c1-4-7-11-22-23(18-10-8-9-12-21(18)31-22)24(29)17-15-19(26)25(20(27)16-17)30-14-13-28(5-2)6-3;/h8-10,12,15-16H,4-7,11,13-14H2,1-3H3;1H
InChkey
ITPDYQOUSLNIHG-UHFFFAOYSA-N
Canonical Smiles
CCCCC1=C(C2=CC=CC=C2O1)C(=O)C3=CC(=C(C(=C3)I)OCCN(CC)CC)I.Cl
Properties
Appearance
green hexagonal plates
Density
1.341
Melting Point
154-158°C
HS Code
29322090
Safety and Handling
Risk Statements
R20/21/22
Safety Statements
S36
Hazard Note
H312; H332
Safety

Moderately toxic by ingestion. Will react with water or steam to produce toxic and corrosive fumes and explosive hydrogen gas. Platinum accelerates the reaction to violence. When Vanadium dichloride (CAS NO.10580-52-6) is heated to decomposition, it emits toxic fumes of VOx. See also HYDROCHLORIC ACID, VANADIUM COMPOUNDS, and CHLORIDES.

Hazard Codes CorrosiveC
Risk Statements 20/21/22-34
R20/21/22: Harmful by inhalation, in contact with skin and if swallowed. 
R34: Vanadium dichloride (CAS NO.10580-52-6) causes burns.
Safety Statements 26-27-36/37/39-45
S26: In case of contact with eyes, rinse immediately with plenty of water and seek medical advice. 
S27: Take off immediately all contaminated clothing. 
S36/37/39: Wear suitable protective clothing, gloves and eye/face protection. 
S45: In case of accident or if you feel unwell, seek medical advice immediately (show the label whenever possible.)
RIDADR UN 3260 8/PG 2
WGK Germany 3
RTECS YW1575000
F 3-10
HazardClass 8
PackingGroup III

Toxicity

Organism Test Type Route Reported Dose (Normalized Dose) Effect Source
rat LD50 oral 540mg/kg (540mg/kg)   American Industrial Hygiene Association Journal. Vol. 30, Pg. 470, 1969.

Transport
UN1230 - class 3 - PG 2 - Methanol, solution
Specification

Safety Statements:26-27-36/37/39-45
26:In case of contact with eyes, rinse immediately with plenty of water and seek medical advice
27:Take off immediately all contaminated clothing
36/37/39:Wear suitable protective clothing, gloves and eye/face protection
45:In case of accident or if you feel unwell, seek medical advice immediately (show label where possible)
Reach Info
MSDS

2.Hazard identification

2.1 Classification of the substance or mixture

Acute toxicity - Dermal, Category 4

Acute toxicity - Inhalation, Category 4

2.2 GHS label elements, including precautionary statements

Pictogram(s)
Signal word

Warning

Hazard statement(s)

H312 Harmful in contact with skin

H332 Harmful if inhaled

Precautionary statement(s)
Prevention

P280 Wear protective gloves/protective clothing/eye protection/face protection.

P261 Avoid breathing dust/fume/gas/mist/vapours/spray.

P271 Use only outdoors or in a well-ventilated area.

Response

P302+P352 IF ON SKIN: Wash with plenty of water/...

P312 Call a POISON CENTER/doctor/\u2026if you feel unwell.

P321 Specific treatment (see ... on this label).

P362+P364 Take off contaminated clothing and wash it before reuse.

P304+P340 IF INHALED: Remove person to fresh air and keep comfortable for breathing.

Storage

none

Disposal

P501 Dispose of contents/container to ...

2.3 Other hazards which do not result in classification

none

Computational chemical data
  • Molecular Weight:681.778g/mol
  • Molecular Formula:C147H239N43O42S2
  • Compound Is Canonicalized:True
  • Exact Mass:681
  • Monoisotopic Mass:681
  • Complexity:547
  • Rotatable Bond Count:11
  • Hydrogen Bond Donor Count:1
  • Hydrogen Bond Acceptor Count:4
  • Topological Polar Surface Area:42.7A^2
  • Heavy Atom Count:32
  • Defined Atom Stereocenter Count:0
  • Undefined Atom Stereocenter Count:0
  • Defined Bond Stereocenter Count:0
  • Undefined Bond Stereocenter Count:0
  • Isotope Atom Count:0
  • Covalently-Bonded Unit Count:2
  • CACTVS Substructure Key Fingerprint: AAADceB6MAAEAwAAAAAAAAAAAAAAASAAAAAwYAAAAAAAAEgB9AAAHgAgAAAADATjmAYyBsMABECI AqBSAAACCAAkIAAIiAEOCMgOJjaMNRqDOWCk4BGYqYeLzPDOoAAAAAAIAABAAAAAABAAAAAAAAAA AA==
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