鸟苷-5'-三磷酸二钠盐

鸟苷-5'-三磷酸二钠盐 基本信息
CAS号 56001-37-7 分子式 C10H16N5O14P3.2Na
分子量 569.15923 精确质量  568.97021
PSA  334.19000 LogP  -0.87810

等价的CAS号:

14356-96-8,24905-71-3,36051-31-7,56001-37-7,61773-63-5

基本信息 展开↓

CAS号:
56001-37-7
3D弹球模型:
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分子式:
C10H16N5O14P3.2Na
分子量:
569.15923
中文名称:
鸟苷-5'-三磷酸二钠盐
英文名称:
Guanosine 5'-(tetrahydrogen triphosphate), sodium salt (1:2)
中文别名:
鸟苷-5'-三磷酸二钠盐;
三磷酸鸟苷二钠盐;
鸟苷-5'-三磷酸二钠
英文别名:
Guanosine 5'-(tetrahydrogen triphosphate), sodium salt (1:2);
Guanosine 5'-(tetrahydrogen triphosphate), disodium salt (9CI);
5'-GTP di-Na salt;
Disodium 5'-GTP;
GTP disodium salt;
Guanosine 5'-triphosphoric acid disodium salt
精确分子量/精确质量:
568.97021
极性分子表面积/PSA:
334.19000
油水分配系数/LogP:

LogP值指的是某物质在正辛醇/水两相体系中的分配系数的对数值,反映了物质在油水两相中的分配情况。其中、LogP值越大,说明该物质越亲油;反之,LogP值越小,则说明该物质越亲水。
EINECS:
252-847-2
InChI:
InChI=1/C10H16N5O14P3/c11-10-13-7-4(8(18)14-10)12-2-15(7)9-6(17)5(16)3(27-9)1-26-31(22,23)29-32(24,25)28-30(19,20)21/h2-3,5-6,9,16-17H,1H2,(H,22,23)(H,24,25)(H2,19,20,21)(H3,11,13,14,18)/p-4/t3-,5-,6-,9-/m1/s1

物化性质展开↓

外观与性状:
无气味的白色固体
熔点:
180°C
沸点:
1028.3ºC at 760mmHg
闪点:
575.7ºC
存储条件/存储方法:

密封、在 -20ºC下保存

稳定性相关:

如果遵照规格使用和储存则不会分解,未有已知危险反应

        

其它信息:

1.       性状:固体

2.       密度(g/mL,15ºC):未确定

3.       相对蒸汽密度(g/mL,空气=1): 未确定

4.       熔点(ºC):180

5.       沸点(ºC):未确定

6.       沸点(ºC0.5mmHg):未确定

7.       折射率:未确定

8.       闪点(°F):未确定

9.       比旋光度(ºC):未确定

10.    自燃点或引燃温度(ºC): 未确定

11.    蒸气压(kPa,25ºC):未确定

12.    饱和蒸气压(kPa,60ºC):未确定

13.    燃烧热(KJ/mol):未确定

14.    临界温度(ºC):未确定

15.    临界压力(KPa):未确定

16.    油水(辛醇/水)分配系数的对数值:未确定

17.    爆炸上限(%,V/V):未确定

18.    爆炸下限(%,V/V):未确定

19.    溶解性:未确定

安全信息展开↓

WGK_Germany:
3
德国有关水污染物质的分类清单
危险类别码:
R36/37/38
安全说明:
26-27-36/37/39
危险标志:
Xi

毒理性展开↓

生态数据:

对水是稍微有危害的不要让未稀释或大量的产品接触地下水、水道或者污水系统,若无政府许可,勿将材料排入周围环境

MSDS 展开↓

Name: Guanosine 5 -triphosphate disodium salt hydrate 95+% (hplc) Material Safety Data Sheet
Synonym: GTP disodium sal
CAS: 56001-37-7
Section 1 - Chemical Product   MSDS Name:Guanosine 5 -triphosphate disodium salt hydrate 95+% (hplc) Material Safety Data Sheet
Synonym:GTP disodium sal

Section 2 - COMPOSITION, INFORMATION ON INGREDIENTS
CAS# Chemical Name content EINECS#
56001-37-7 Guanosine 5'-triphosphate, disodium sa 259-940-7
Hazard Symbols: None Listed.
Risk Phrases: None Listed.

Section 3 - HAZARDS IDENTIFICATION
  EMERGENCY OVERVIEW
Moisture sensitive.
Potential Health Effects
Eye:
May cause eye irritation.
Skin:
May cause skin irritation.
Ingestion:
The toxicological properties of this substance have not been fully investigated.
Inhalation:
May cause respiratory tract irritation.
Chronic:
Not available.

Section 4 - FIRST AID MEASURES
  Eyes: Flush eyes with plenty of water for at least 15 minutes, occasionally lifting the upper and lower eyelids.
Skin:
Flush skin with plenty of water for at least 15 minutes while removing contaminated clothing and shoes.
Ingestion:
Get medical aid. Wash mouth out with water.
Inhalation:
Remove from exposure and move to fresh air immediately.
Notes to Physician:

Section 5 - FIRE FIGHTING MEASURES
  General Information:
As in any fire, wear a self-contained breathing apparatus in pressure-demand, MSHA/NIOSH (approved or equivalent), and full protective gear.
Extinguishing Media:
Use water spray, dry chemical, carbon dioxide, or chemical foam.

Section 6 - ACCIDENTAL RELEASE MEASURES
  General Information: Use proper personal protective equipment as indicated in Section 8.
Spills/Leaks:
Vacuum or sweep up material and place into a suitable disposal container.

Section 7 - HANDLING and STORAGE
  Handling:
Avoid breathing dust, vapor, mist, or gas. Avoid contact with skin and eyes.
Storage:
Store in a tightly closed container. Keep under an argon blanket.
Keep refrigerated. (Store below 4C/39F.)

Section 8 - EXPOSURE CONTROLS, PERSONAL PROTECTION
  Engineering Controls:
Facilities storing or utilizing this material should be equipped with an eyewash facility and a safety shower.
Exposure Limits CAS# 56001-37-7: Personal Protective Equipment Eyes: Wear chemical splash goggles.
Skin:
Wear appropriate protective gloves to prevent skin exposure.
Clothing:
Wear a chemical apron.
Respirators:
A NIOSH/MSHA approved air purifying dust or mist respirator or European Standard EN 149.

Section 9 - PHYSICAL AND CHEMICAL PROPERTIES
 
Physical State: Solid
Color: white
Odor: Odorless
pH: Not available.
Vapor Pressure: Not available.
Viscosity: Not available.
Boiling Point: Not available.
Freezing/Melting Point: 180 deg C
Autoignition Temperature: Not available.
Flash Point: Not available.
Explosion Limits, lower: Not available.
Explosion Limits, upper: Not available.
Decomposition Temperature:
Solubility in water: soluble in water
Specific Gravity/Density:
Molecular Formula: C10H14N5O14P3Na2.2H2O
Molecular Weight: 567.14

Section 10 - STABILITY AND REACTIVITY
  Chemical Stability:
Not available.
Conditions to Avoid:
High temperatures, incompatible materials, heating to decomposition, exposure to moist air or water.
Incompatibilities with Other Materials:
Strong oxidizing agents.
Hazardous Decomposition Products:
Carbon monoxide, oxides of nitrogen, oxides of phosphorus, carbon dioxide.
Hazardous Polymerization: Will not occur.

Section 11 - TOXICOLOGICAL INFORMATION
  RTECS#:
CAS# 56001-37-7 unlisted.
LD50/LC50:
Not available.
Carcinogenicity:
Guanosine 5'-triphosphate, disodium salt dihydrate - Not listed by ACGIH, IARC, or NTP.

Section 12 - ECOLOGICAL INFORMATION
  Ecotoxicity:
Water danger/protection: WGK 1

Section 13 - DISPOSAL CONSIDERATIONS
  Dispose of in a manner consistent with federal, state, and local regulations.

Section 14 - TRANSPORT INFORMATION
 
IATA
Not regulated as a hazardous material.
IMO
Not regulated as a hazardous material.
RID/ADR
Not regulated as a hazardous material.

Section 15 - REGULATORY INFORMATION
 
European/International Regulations
European Labeling in Accordance with EC Directives
Hazard Symbols: Not available.
Risk Phrases:
Safety Phrases:
S 24/25 Avoid contact with skin and eyes.
WGK (Water Danger/Protection)
CAS# 56001-37-7: 1
Canada
None of the chemicals in this product are listed on the DSL/NDSL list.
CAS# 56001-37-7 is not listed on Canada's Ingredient Disclosure List.
US FEDERAL
TSCA
CAS# 56001-37-7 is not listed on the TSCA inventory.
It is for research and development use only.


SECTION 16 - ADDITIONAL INFORMATION
N/A

分子结构与计算化学数据展开↓

计算化学数据


1、   疏水参数计算参考值(XlogP):-6.8

2、   氢键供体数量:4

3、   氢键受体数量:17

4、   可旋转化学键数量:7

5、   互变异构体数量:6

6、   拓扑分子极性表面积(TPSA):306

7、   重原子数量:32

8、   表面电荷:-4

9、   复杂度:899

10、同位素原子数量:0

11、确定原子立构中心数量:4

12、不确定原子立构中心数量:0

13、确定化学键立构中心数量:0

14、不确定化学键立构中心数量:0

15、共价键单元数量:1

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