12671-00-0 (碳酸锆,Zirconium carbonate oxide)

结构式:
CAS号:
12671-00-0
中文名称:
碳酸锆
英文名称:
Zirconium carbonate oxide
分子式:
CH4O10Zr3
分子量:
449.708458900452

碳酸锆(12671-00-0)名称与标识符

名称

中文别名:
碳酸锆;4,4-二氟环己-1-烯基硼酸频那醇酯;碱性碳酸锆;水合碳酸锆;碳酸锆(IV)碱性水合物;
英文别名:
Zirconium carbonate oxide;(Carbonato)pentaoxotrizirconium;oxygen(2-),zirconium(4+),carbonate,hydrate;ZIRCONIUM (IV) CARBONATE, BASIC HYDRATE;Zirconium carbonate;UNII-2LCY12E5AT;Zirconium carbonate monohydrate;Zirconium carbonate oxide hydrate;ZirconiuM Carbonate (ZrC);ZIRCONIUM CARBONATE, BASIC;ZIRCONIUM CARBONATE, BASIC HYDRATE;Zirconium carbonate basic hydrate white powder;Zirconium carbonate oxide (Zr3(CO3)O5), monohydrate;ZIRCONIUM(IV)CARBONATE, BASIC HYDRATE;

标识符

InChIKey:
YGCRTSJWNHPGDG-UHFFFAOYSA-H
Inchi:
1S/CH2O3.4H2O.3O.3Zr/c2-1(3)4;;;;;;;;;;/h(H2,2,3,4);4*1H2;;;;;;/q;;;;;;;;+1;+2;+3/p-6
SMILES:
[Zr]12(OC(O[Zr](O)(O)O1)=O)O[Zr](O)(O)O2

碳酸锆(12671-00-0)物化性质

实验特性

  • LogP : -0.84420
  • PSA : 144.14000
  • 沸点 : °Cat760mmHg
  • 熔点 : 135 °C (dec.)(lit.)
  • 闪点 : °C
  • 颜色与性状 : 暗灰色有金属光泽的立方晶体。性脆。
  • 稳定性 : Stable. Not flammable.
  • 溶解性 : 易溶于有机酸和无机盐,可溶于碳酸铵;不溶于水和有机溶剂,

计算特性

  • 精确分子量 : 445.69500
  • 氢键供体数量 : 2
  • 氢键受体数量 : 7
  • 可旋转化学键数量 : 0
  • 重原子数量 : 10
  • 复杂度 : 39.8
  • 同位素原子数量 : 0
  • 确定原子立构中心数量 : 0
  • 不确定原子立构中心数量 : 0
  • 确定化学键立构中心数量 : 0
  • 不确定化学键立构中心数量 : 0
  • 共价键单元数量 : 5
  • 表面电荷 : 0
  • 拓扑分子极性表面积 : 99.3

碳酸锆(12671-00-0)安全信息

碳酸锆(12671-00-0)国际标准相关数据

EINECS:
603-154-2

碳酸锆(12671-00-0)海关数据

海关编码:
2836999000
海关数据:

中国海关编码:

2836999000

碳酸锆(12671-00-0)生产方法和用途

用途:
碳化锆是一种硬度大的高熔点材料和极好的高温耐火材料。用做火箭发动机中固体推进剂的一种原料。用于生产合金钢。也是生产金属锆和四氯化锆原料,以及有前途的精细陶瓷材料。

碳酸锆(12671-00-0) MSDS

基础信息


Section 1: Product Identification
   Chemical Name:       Zirconium (IV) carbonate, basic hydrate    
   CAS Registry Number:       12671-00-0    
   Formula:       3ZrO2.CO2.XH2O    
   EINECS Number:       none    
   Chemical Family:       metal carbonate    
   Synonym:       Carbonic acid, zirconium salt    

Section 2: Composition and Information on Ingredients
   Ingredient       CAS Number       Percent       ACGIH (TWA)       OSHA (PEL)    
   Title Compound       12671-00-0       100%       5mg/m3 (as Zr)       5mg/m3 (as Zr)    

Section 3: Hazards Identification
   Emergency Overview:       Irritating to the respiratory tract, skin and eyes. May be harmful if swallowed.    
   Primary Routes of Exposure:       Ingestion    
   Eye Contact:       Causes slight to mild irritation of the eyes.    
   Skin Contact:       Causes slight to mild irritation of the skin.    
   Inhalation:       Irritating to skin, eyes and respiratory tract.    
   Ingestion:       No information is available on the physiological effects of ingestion.    
   Acute Health Affects:       Irritating to skin, eyes and respiratory tract.    
   Chronic Health Affects:       No information available on long term chronic effects.    
   NTP:       No    
   IARC:       No    
   OSHA:       No    

SECTION 4: First Aid Measures
   Immediately flush the eyes with copious amounts of water for at least 10-15 minutes. A victim may need
   Eye Exposure:
   assistance in keeping their eye lids open. Get immediate medical attention.
   Wash the affected area with water. Remove contaminated clothes if necessary. Seek medical assistance if
   Skin Exposure:
   irritation persists.
   Remove the victim to fresh air. Closely monitor the victim for signs of respiratory problems, such as difficulty
   Inhalation:
   in breathing, coughing, wheezing, or pain. In such cases seek immediate medical assistance.
   Seek medical attention immediately. Keep the victim calm. Give the victim water (only if conscious). Induce
   Ingestion:
   vomiting only if directed by medical personnel.

SECTION 5: Fire Fighting Measures
   Flash Point:       not applicable    
   Autoignition Temperature:       none    
   Explosion Limits:       none    
   Extinguishing Medium:       none required    
   If involved in a fire, fire fighters should be equipped with a NIOSH approved positive pressure self-contained
   Special Fire Fighting Procedures:
   breathing apparatus and full protective clothing.
   Hazardous Combustion and       None    
   Decomposion Products:
   Unusual Fire or Explosion Hazards: No unusual fire or explosion hazards.

SECTION 6: Accidental Release Measures
   Spill and Leak Procedures:       Small spills can be mixed with powdered sodium carbonate or ground limestone and swept up.    

SECTION 7: Handling and Storage
   Handling and Storage:       Store material in a tightly sealed bottle away from moisture.    

SECTION 8: Exposure Controls and Personal Protection
   Eye Protection:       Always wear approved safety glasses when handling a chemical substance in the laboratory.    
   Wear appropriate chemical resistant gloves and protective clothing.
   Skin Protection:
   Wear appropriate chemical resistant gloves and protective clothing.
   Ventilation:       If possible, handle the material in an efficient fume hood.    
   In the absence of adequate ventilation a respirator should be worn. The use of a respiratory requires a
   Respirator:
   Respirator Protection Program to be in compliance with 29 CFR 1910.134.
   Ventilation:       If possible, handle the material in an efficient fume hood.    
   Additional Protection:       No additional protection required.    

SECTION 9: Physical and Chemical Properties
   Color and Form:       white pwdr.    
   Molecular Weight:       431.68    
   Melting Point:       no data    
   Boiling Point:       no data    
   Vapor Pressure:       no data    
   Specific Gravity:       no data    
   Odor:       none    
   Solubility in Water:       insoluble    

SECTION 10: Stability and Reactivity
   Stability:       air and moisture stable    
   Hazardous Polymerization:       no hazardous polymerization    
   Conditions to Avoid:       Strong acids    
   Incompatibility:       none    
   Decomposition Products:       none    

SECTION 11: Toxicological Information
   RTECS Data:       No information available in the RTECS files.    
   Carcinogenic Effects:       no data    
   Mutagenic Effects:       no data    
   Tetratogenic Effects:       no data    

SECTION 12: Ecological Information
   Ecological Information:       No information available    

SECTION 13: Disposal Considerations
   Disposal:       Dispose of according to local, state and federal regulations.    

SECTION 14: Transportation
   Shipping Name (CFR):       Non-hazardous    
   Hazard Class (CFR):       NA    
   Additional Hazard Class (CFR):       NA    
   Packaging Group (CFR):       NA    
   UN ID Number (CFR):       NA    
   Shipping Name (IATA):       Non-hazardous    
   Hazard Class (IATA):       NA    
   Additional Hazard Class (IATA):       NA    
   Packaging Group (IATA):       NA    
   UN ID Number (IATA):       NA    

SECTION 15: Regulatory Information
   TSCA:       Not listed in the TSCA inventory.    
   SARA (Title 313):       Title compound not listed    
   Second Ingredient:       none    


SECTION 16 - ADDITIONAL INFORMATION
N/A