98-44-2 (2-氨基-1,4-苯二磺酸,2-Aminobenzene-1,4-disulfonic Acid (>90%))

CAS号:
98-44-2
中文名称:
2-氨基-1,4-苯二磺酸
英文名称:
2-Aminobenzene-1,4-disulfonic Acid (>90%)
安全信息:
分子式:
C6H7NO6S2
分子量:
253.25287938118

2-氨基-1,4-苯二磺酸(98-44-2)名称与标识符

名称

中文别名:
2-氨基-1,4-苯二磺酸;苯胺-2,5-双磺酸;苯胺-2,5-二磺酸;苯胺-2.5-双磺酸;
英文别名:
2-Aminobenzene-1,4-disulfonic acid;Aniline-2,5-disulfonic acid;2,5-Disulfoaniline;2-Amino-1,4-benzenedisulfonic acid;1-Amino-2,5-benzenedisulfonic acid;4-Sulfometanilic acid;2-Amino-p-benzenedisulfonic acid;1,4-BENZENEDISULFONIC ACID, 2-AMINO-;2-Amino-1,4-disulfobenzene;2,5-Disulfo-1-aminobenzene;2-Aminobenzene-1,4-disulphonic acid;1-Anilino-2,5-disulfonic acid;p-Benzenedisulfonic acid, 2-amino-;Kyselina anilin-2,5-disulfonova;5E2OT6T;3-14-00-02260 (Beilstein Handbook Reference);6-AMINOBENZENE-1,4-DISULFONIC ACID;MFCD00035753;EINECS 202-669-6;A845862;NSC5580;Tox21_301960;Kyselina anilin-2,5-disulfonova [Czech];UNII-5E2OT6T2PS;FT-0607352;DTXCID6024751;NSC 5580;C6H7NO6S2;BRN 2660550;3-aminobenzene-1,2-disulfonic acid;2,5-disulfoaniline, AldrichCPR;NCGC00256123-01;D95943;CHEMBL3184682;LDCCBULMAFILCT-UHFFFAOYSA-N;AI3-23218;Q27261901;AS-12819;CAS-98-44-2;DTXSID8044751;SCHEMBL149375;Aniline 2,5-disulfonic acid;aniline 2,5 disulphonic acid;5E2OT6T2PS;WLN: WSQR BZ DSWQ;98-44-2;NS00005495;1-Aminobenzene-2,5-disulfonic acid;AKOS015854615;NSC-5580;EC 202-669-6;2-Aminobenzene-1,4-disulfonic Acid (>90%);DB-057728;

标识符

MDL:
MFCD00035753
InChIKey:
LDCCBULMAFILCT-UHFFFAOYSA-N
Inchi:
1S/C6H7NO6S2/c7-5-3-4(14(8,9)10)1-2-6(5)15(11,12)13/h1-3H,7H2,(H,8,9,10)(H,11,12,13)
SMILES:
S(C1C=CC(=CC=1N)S(=O)(=O)O)(=O)(=O)O
BRN:
2660550

2-氨基-1,4-苯二磺酸(98-44-2)物化性质

实验特性

  • LogP : 2.50500
  • PSA : 151.52000
  • 折射率 : 1.5500 (estimate)
  • 水溶性 : Slightly soluble in water.
  • 沸点 : 500
  • 熔点 : >360°C
  • 闪点 : No data available
  • 颜色与性状 : 黄色结晶。
  • 溶解性 : 易溶于水和乙醇。
  • 密度 : 1.569 (estimate)

计算特性

  • 精确分子量 : 252.97100
  • 氢键供体数量 : 3
  • 氢键受体数量 : 7
  • 可旋转化学键数量 : 2
  • 同位素质量 : 252.971478
  • 重原子数量 : 15
  • 复杂度 : 416
  • 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 : 1
  • 疏水参数计算参考值(XlogP) : -0.2
  • 互变异构体数量 : 无
  • 表面电荷 : 0
  • 拓扑分子极性表面积 : 152

2-氨基-1,4-苯二磺酸(98-44-2)国际标准相关数据

EINECS:
5580

2-氨基-1,4-苯二磺酸(98-44-2)海关数据

海关编码:
2921499090
海关数据:

中国海关编码:

2921499090

概述:

2921499090 其他芳香单胺及衍生物及它们的盐. 增值税率:17.0% 退税率:9.0% 监管条件:无 最惠国关税:6.5% 普通关税:30.0%

申报要素:

品名, 成分含量, 用途

Summary:

2921499090 other aromatic monoamines and their derivatives; salts thereof VAT:17.0% Tax rebate rate:9.0% Supervision conditions:none MFN tariff:6.5% General tariff:30.0%

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2-氨基-1,4-苯二磺酸(98-44-2)相关文献

2-氨基-1,4-苯二磺酸(98-44-2)参考资料

Beilstein:
202-669-6
PubChem CID:

2-氨基-1,4-苯二磺酸(98-44-2) MSDS

基础信息

Name:2 5-Disulfoaniline 95% Material Safety Data Sheet
Synonym:
CAS:98-44-2
Section 1 - Chemical Product ? MSDS Name:2 5-Disulfoaniline 95% Material Safety Data Sheet
Synonym:

Section 2 - COMPOSITION, INFORMATION ON INGREDIENTS
CAS#Chemical NamecontentEINECS#
98-44-22,5-Disulfoaniline95%202-669-6
Hazard Symbols: XI
Risk Phrases: 36/37/38

Section 3 - HAZARDS IDENTIFICATION
? EMERGENCY OVERVIEW
Irritating to eyes, respiratory system and skin.
Potential Health Effects
Eye:
Causes eye irritation.
Skin:
Causes skin irritation. May be harmful if absorbed through the skin.
Ingestion:
May cause irritation of the digestive tract. May be harmful if swallowed.
Inhalation:
Causes respiratory tract irritation. May be harmful if inhaled.
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. Get medical aid.
Skin:
Get medical aid. 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. If not breathing, give artificial respiration. If breathing is difficult, give oxygen. Get medical aid.
Notes to Physician:
Treat symptomatically and supportively.

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 foam, dry chemical, or carbon dioxide.

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 cool, dry place. Store in a tightly closed container.

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. Use adequate ventilation to keep airborne concentrations low.
Exposure Limits CAS# 98-44-2: Personal Protective Equipment Eyes: Not available.
Skin:
Wear appropriate protective gloves to prevent skin exposure.
Clothing:
Wear appropriate protective clothing to prevent skin exposure.
Respirators:
Follow the OSHA respirator regulations found in 29 CFR 1910.134 or European Standard EN 149. Use a NIOSH/MSHA or European Standard EN 149 approved respirator if exposure limits are exceeded or if irritation or other symptoms are experienced.

Section 9 - PHYSICAL AND CHEMICAL PROPERTIES
?
Physical State: Powder
Color: off-white
Odor: Not available.
pH: Not available.
Vapor Pressure: Not available.
Viscosity: Not available.
Boiling Point: Not available.
Freezing/Melting Point: Not available.
Autoignition Temperature: Not available.
Flash Point: Not available.
Explosion Limits, lower: Not available.
Explosion Limits, upper: Not available.
Decomposition Temperature:
Solubility in water:
Specific Gravity/Density:
Molecular Formula: C6H7NO6S2
Molecular Weight: 253.2

Section 10 - STABILITY AND REACTIVITY
? Chemical Stability:
Not available.
Conditions to Avoid:
Incompatible materials.
Incompatibilities with Other Materials:
Strong oxidizing agents, acids, acetic anhydride, acid chlorides, carbon dioxide.
Hazardous Decomposition Products:
Nitrogen oxides, carbon monoxide, carbon dioxide, sulfur oxides (SOx), including sulfur oxide and sulfur dioxide.
Hazardous Polymerization: Has not been reported

Section 11 - TOXICOLOGICAL INFORMATION
? RTECS#:
CAS# 98-44-2: CZ9250000 LD50/LC50:
CAS# 98-44-2: Draize test, rabbit, eye: 100 mg/24H Moderate; Draize test, rabbit, skin: 500 mg/24H Mild.
Carcinogenicity:
2,5-Disulfoaniline - Not listed by ACGIH, IARC, or NTP.
Other:
See actual entry in RTECS for complete information.

Section 12 - ECOLOGICAL INFORMATION
?

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

Section 14 - TRANSPORT INFORMATION
?
IATA
No information available.
IMO
No information available.
RID/ADR
No information available.

Section 15 - REGULATORY INFORMATION
?
European/International Regulations
European Labeling in Accordance with EC Directives
Hazard Symbols: XI
Risk Phrases:
R 36/37/38 Irritating to eyes, respiratory system
and skin.
Safety Phrases:
S 26 In case of contact with eyes, rinse immediately
with plenty of water and seek medical advice.
S 37/39 Wear suitable gloves and eye/face
protection.
WGK (Water Danger/Protection)
CAS# 98-44-2: 1
Canada
CAS# 98-44-2 is listed on Canada's NDSL List.
CAS# 98-44-2 is listed on Canada's Ingredient Disclosure List.
US FEDERAL
TSCA
CAS# 98-44-2 is listed on the TSCA inventory.


SECTION 16 - ADDITIONAL INFORMATION
N/A