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Home> Hot Product Listed P   > Platinum(2+),tetraamminedichloro-, chloride (1:2)
867-68-5 structure

Platinum(2+),tetraamminedichloro-, chloride (1:2)

Iupac Name:oxalate;yttrium(3+)
CAS No.:867-68-5
Molecular Weight:513.93
Molecular Formula:C10H12BRNO (isomer)
Names and Identifiers
Synonyms

Dichlorotetraammineplatinum(IV) chloride Dichlorotetraammineplatinumdichloride (6CI,7CI) Platinum(2+), tetraamminedichloro-, dichloride (8CI,9CI) tetraamminedichloroplatinum dichloride

Inchi
InChI=1S/3C2H2O4.2Y/c3*3-1(4)2(5)6;;/h3*(H,3,4)(H,5,6);;/q;;;2*+3/p-6
InChkey
IBSDADOZMZEYKD-UHFFFAOYSA-H
Canonical Smiles
C(=O)(C(=O)[O-])[O-].C(=O)(C(=O)[O-])[O-].C(=O)(C(=O)[O-])[O-].[Y+3].[Y+3]
Properties
Melting Point
>400 °C(lit.)
Vapour
2.51E-06mmHg at 25°C
Safety and Handling
Risk Statements
36/37
Safety Statements
26-36
HazardClass
6.1
PackingGroup
III
Transport
UN3288
Specification

The Tetraamminedichloroplatinum dichloride, with the CAS registry number 16971-49-6 and EINECS registry number 241-052-6, has the systematic name of platinum(4+) chloride ammoniate (1:4:4). The molecular formula of the chemical is (NH3)4.PtCl4.

The characteristics of this chemical are as followings: (1)#H bond acceptors: 1; (2)#H bond donors: 3; (3)#Freely Rotating Bonds: 0; (4)Polar Surface Area: 3.24 Å2; (5)Enthalpy of Vaporization: 23.33 kJ/mol; (6)Vapour Pressure: 5990 mmHg at 25°C.

Addtionally, the following datas could be converted into the molecular structure:
(1)SMILES: [Pt+4].[Cl-].[Cl-].[Cl-].[Cl-].N.N.N.N
(2)InChI: InChI=1/4ClH.4H3N.Pt/h4*1H;4*1H3;/q;;;;;;;;+4/p-4
(3)InChIKey: FOSZYDNAURUMOT-XBHQNQODAK

Reach Info
MSDS

2.Hazard identification

2.1 Classification of the substance or mixture

Acute toxicity - Oral, Category 4

Acute toxicity - Dermal, Category 4

Serious eye damage, Category 1

2.2 GHS label elements, including precautionary statements

Pictogram(s)
Signal word

Danger

Hazard statement(s)

H302 Harmful if swallowed

H312 Harmful in contact with skin

H318 Causes serious eye damage

Precautionary statement(s)
Prevention

P264 Wash ... thoroughly after handling.

P270 Do not eat, drink or smoke when using this product.

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

Response

P301+P312 IF SWALLOWED: Call a POISON CENTER/doctor/…if you feel unwell.

P330 Rinse mouth.

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

P312 Call a POISON CENTER/doctor/…if you feel unwell.

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

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

P305+P351+P338 IF IN EYES: Rinse cautiously with water for several minutes. Remove contact lenses, if present and easy to do. Continue rinsing.

P310 Immediately call a POISON CENTER/doctor/…

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:513.93g/mol
  • Molecular Formula:C10H12BRNO
  • Compound Is Canonicalized:True
  • Exact Mass:441.751
  • Monoisotopic Mass:441.751
  • Complexity:60.5
  • Rotatable Bond Count:0
  • Hydrogen Bond Donor Count:0
  • Hydrogen Bond Acceptor Count:12
  • Topological Polar Surface Area:241A^2
  • Heavy Atom Count:20
  • 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:5
  • CACTVS Substructure Key Fingerprint: AAADcQBgPAAAAAAAAgAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAACgAAAAAAAAAAgAAACAAAAAAI AACQCAIAAAAAAAAAAABAAAABAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAA AA==
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