6-Benzothiazolesulfonicacid, 2,2'-(1,2-hydrazinediylidene)bi

物化性质

外观与性状：

淡绿色粉末

沸点：

881.2ºC at 760mmHg

闪点：

486.7ºC

存储条件/存储方法：

通风低温干燥

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：块状

2. 密度（g/mL,20℃）：未确定

3. 相对蒸汽密度（g/mL,空气=1）：未确定

4. 熔点（ºC）：未确定

5. 沸点（ºC,常压）：未确定

6. 沸点（ºC, KPa）：未确定

7. 折射率：未确定

8. 闪点（ºC）：未确定

9. 比旋光度（º）：未确定

10. 自燃点或引燃温度（ºC）：未确定

11. 蒸气压（Pa,20ºC）：未确定

12. 饱和蒸气压（KPa,20ºC）：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：H₂O: 50mg/mL

安全信息

外观与性状：

淡绿色粉末

沸点：

881.2ºC at 760mmHg

闪点：

486.7ºC

存储条件/存储方法：

通风低温干燥

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：块状

2. 密度（g/mL,20℃）：未确定

3. 相对蒸汽密度（g/mL,空气=1）：未确定

4. 熔点（ºC）：未确定

5. 沸点（ºC,常压）：未确定

6. 沸点（ºC, KPa）：未确定

7. 折射率：未确定

8. 闪点（ºC）：未确定

9. 比旋光度（º）：未确定

10. 自燃点或引燃温度（ºC）：未确定

11. 蒸气压（Pa,20ºC）：未确定

12. 饱和蒸气压（KPa,20ºC）：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：H₂O: 50mg/mL

毒理性

CHEMICAL IDENTIFICATION

RTECS NUMBER :

DL7002000

CAS REGISTRY NUMBER :

30931-67-0

LAST UPDATED :

199410

DATA ITEMS CITED :

2

MOLECULAR FORMULA :

C18-H16-N4-O6-S4.2H4-N

MOLECULAR WEIGHT :

548.72

WISWESSER LINE NOTATION :

T56 BNYSJ B2 GSWQ CUNNU- CT56 BNYSJ B2 GSWQ &ZH 2

HEALTH HAZARD DATA

ACUTE TOXICITY DATA

MUTATION DATA

TYPE OF TEST :

Mutation in microorganisms

TEST SYSTEM :

Bacteria - Klebsiella pneumoniae

DOSE/DURATION :

11 gm/L

REFERENCE :

JIMMBG Journal of Immunological Methods. (Elsevier Science Pub. Co., Inc., 52 Vanderbilt Ave., New York, NY 10017) V.1- 1971- Volume(issue)/page/year: 36,55,1980

毒理学数据：

1、 致突变性：沙门氏菌微生物突变实验：100mg/L

肺炎克雷伯氏菌微生物突变实验：11mg/L

生态数据：

若无政府许可，勿将材料排入周围环境。

MSDS

Section I.Chemical Product and Company Identification
Chemical NameABTS [=2,2'-Azinobis(3-ethylbenzothiazoline-
6-sulfonic Acid Ammonium Salt)] [for Biochemical
Research]
Portland OR
Synonym2,2'-Azinobis(3-ethylbenzothiazoline-6-sulfonic Acid
Ammonium Salt)
Chemical FormulaC18H24N6O6S4
CAS Number30931-67-0
Section II.Composition and Information on Ingredients
CAS Number Percent (%)TLV/PELToxicology Data
Chemical Name
ABTS [=2,2'-Azinobis(3-ethylbenzothiazoline-Min. 98.0 (N) Not available.Not available.
30931-67-0
6-sulfonic Acid Ammonium Salt)] [for Biochemical
Research]
Section III. Hazards Identification
Irritating to eyes and skin on contact. Inhalation causes irritation of the lungs and respiratory system. Inflammation of the
Acute Health Effects
eye is characterized by redness, watering, and itching. Skin inflammation is characterized by itching, scaling, reddening, or,
occasionally, blistering.
Follow safe industrial hygiene practices and always wear proper protective equipment when handling this compound.
CARCINOGENIC EFFECTS : Not available.
Chronic Health Effects
MUTAGENIC EFFECTS : Not available.
TERATOGENIC EFFECTS : Not available.
DEVELOPMENTAL TOXICITY: Not available.
Repeated or prolonged exposure to this compound is not known to aggravate existing medical conditions.
Section IV.First Aid Measures
Check for and remove any contact lenses. In case of contact, immediately flush eyes with plenty of water for at least 15
Eye Contact
minutes. COLD water may be used. Get medical attention.
Skin ContactIn case of contact, immediately flush skin with plenty of water. Remove contaminated clothing and shoes. COLD water may
be used.Wash clothing before reuse. Thoroughly clean shoes before reuse. Get medical attention.
InhalationIf the victim is not breathing, perform mouth-to-mouth resuscitation. Loosen tight clothing such as a collar, tie, belt or
waistband. If breathing is difficult, oxygen can be administered. Seek medical attention if respiration problems do not
improve.
IngestionINDUCE VOMITING by sticking finger in throat. Lower the head so that the vomit will not reenter the mouth and throat.
Loosen tight clothing such as a collar, tie, belt or waistband. If the victim is not breathing, perform mouth-to-mouth
resuscitation. Examine the lips and mouth to ascertain whether the tissues are damaged, a possible indication that the toxic
material was ingested; the absence of such signs, however, is not conclusive.
Section V.Fire and Explosion Data
Not available.
Auto-Ignition
FlammabilityMay be combustible at high temperature.
Flammable LimitsNot available.
Flash PointsNot available.
Combustion ProductsThese products are toxic carbon oxides (CO, CO2), nitrogen oxides (NO, NO2), sulfur oxides (SO2, SO3...).
Fire Hazards
Not available.
Risks of explosion of the product in presence of mechanical impact: Not available.
Explosion Hazards
Risks of explosion of the product in presence of static discharge: Not available.
Fire Fighting Media
SMALL FIRE: Use DRY chemical powder.
LARGE FIRE: Use water spray, fog or foam. DO NOT use water jet.
and Instructions
Consult with local fire authorities before attempting large scale fire-fighting operations.
Continued on Next Page
ABTS [=2,2'-Azinobis(3-ethylbenzothiazoline-
6-sulfonic Acid Ammonium Salt)] [for Biochemical Research]
Section VI.Accidental Release Measures
Spill CleanupIrritating Material.
Use a shovel to put the material into a convenient waste disposal container. Finish cleaning the spill by rinsing any
Instructions
contaminated surfaces with copious amounts of water. Consult federal, state, and/or local authorities for assistance on
disposal.
Section VII. Handling and Storage
IRRITANT. Keep away from heat. Mechanical exhaust required. When not in use, tightly seal the container and store in a
Handling and Storage
dry, cool place. Avoid excessive heat and light. Do not breathe dust.
Information
Always store away from incompatible compounds such as oxidizing agents.
Section VIII. Exposure Controls/Personal Protection
Engineering ControlsUse process enclosures, local exhaust ventilation, or other engineering controls to keep airborne levels below recommended
exposure limits. If user operations generate dust, fume or mist, use ventilation to keep exposure to airborne contaminants
below the exposure limit.
Personal ProtectionSplash goggles. Lab coat. Boots. Gloves. Suggested protective clothing might not be sufficient; consult a specialist
BEFORE handling this product. Be sure to use a MSHA/NIOSH approved respirator or equivalent.
Not available.
Exposure Limits
Section IX. Physical and Chemical Properties
Physical state @ 20°CSolid. (Crystalline powder. White to slightlySolubilitySoluble in cold water.
pale green.)
Not available.
Specific Gravity
Molecular Weight548.68Partition CoefficientNot available.
Boiling PointNot available.Vapor PressureNot applicable.
Melting Point300°C (572°F)Vapor DensityNot available.
Not available.Not available.
Refractive IndexVolatility
Not available.
Critical TemperatureNot available.Odor
ViscosityNot available.TasteNot available.
Section X.Stability and Reactivity Data
StabilityThis material is stable if stored under proper conditions. (See Section VII for instructions)
Conditions of InstabilityAvoid excessive heat and light.
Incompatibilities
Reactive with oxidizing agents.
Section XI. Toxicological Information
RTECS NumberDL7002000
Eye Contact. Ingestion. Inhalation.
Routes of Exposure
Toxicity DataNot available.
CARCINOGENIC EFFECTS : Not available.
Chronic Toxic Effects
MUTAGENIC EFFECTS : Not available.
TERATOGENIC EFFECTS : Not available.
DEVELOPMENTAL TOXICITY: Not available.
Repeated or prolonged exposure to this compound is not known to aggravate existing medical conditions.
Acute Toxic EffectsIrritating to eyes and skin on contact. Inhalation causes irritation of the lungs and respiratory system. Inflammation of the eye
is characterized by redness, watering, and itching. Skin inflammation is characterized by itching, scaling, reddening, or,
occasionally, blistering.
Follow safe industrial hygiene practices and always wear proper protective equipment when handling this compound.
Continued on Next Page
ABTS [=2,2'-Azinobis(3-ethylbenzothiazoline-
6-sulfonic Acid Ammonium Salt)] [for Biochemical Research]
Section XII.Ecological Information
Not available.
Ecotoxicity
Environmental FateNot available.
Section XIII. Disposal Considerations
Recycle to process, if possible. Consult your local regional authorities. You may be able to dissolve or mix material with a
Waste Disposal
combustible solvent and burn in a chemical incinerator equipped with an afterburner and scrubber system. Observe all
federal, state and local regulations when disposing of the substance.
Section XIV. Transport Information
DOT ClassificationNot a DOT controlled material (United States).
PIN NumberNot applicable.
Proper Shipping NameNot applicable.
Packing Group (PG)Not applicable.
DOT Pictograms
Section XV. Other Regulatory Information and Pictograms
TSCA Chemical InventoryThis product is NOT on the EPA Toxic Substances Control Act (TSCA) inventory. The following notices are required by 40
CFR 720.36 (C) for those products not on the inventory list:
(EPA)
(i) These products are supplied solely for use in research and development by or under the supervision of a technically
qualified individual as defined in 40 CFR 720.0 et sec.
(ii) The health risks of these products have not been fully determined. Any information that is or becomes available will be
supplied on an MSDS sheet.
WHMIS ClassificationOn DSL.
(Canada)
EINECS Number (EEC) 250-396-6
EEC Risk Statements
R36/37/38- Irritating to eyes, respiratory system and skin.
SECTION 16 - ADDITIONAL INFORMATION
N/A

分子结构与计算化学数据

计算化学数据

1、 疏水参数计算参考值（XlogP）：

2、 氢键供体数量：2

3、 氢键受体数量：10

4、 可旋转化学键数量：3

5、 互变异构体数量：

6、 拓扑分子极性表面积（TPSA）：148

7、 重原子数量：34

8、 表面电荷：0

9、 复杂度：883

10、同位素原子数量：0

11、确定原子立构中心数量：0

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：2

14、不确定化学键立构中心数量：0

15、共价键单元数量：3