(5-甲基-2-苯基-2H-1,2,3-噻唑-4-基)甲醇

(5-甲基-2-苯基-2H-1,2,3-噻唑-4-基)甲醇 基本信息
CAS号 13322-19-5 分子式 C10H11N3O
分子量 189.21400 精确质量 　189.09000
PSA 　50.94000 LogP 　1.06800
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目录
基本信息 物化性质 安全信息 合成路线 MSDS 海关数据 上下游

基本信息 展开↓

CAS号：
13322-19-5
3D弹球模型：
立即前往扯扯看
分子式：
C10H11N3O
分子量：
189.21400
中文名称：
(5-甲基-2-苯基-2H-1,2,3-噻唑-4-基)甲醇
英文名称：
(5-Methyl-2-phenyl-2H-1,2,3-triazol-4-yl)methanol
中文别名：
(5-甲基-2-苯基-2H-1,2,3-噻唑-4-基)甲醇;
trifluoroborane dihydrate;
Boron Trifluoride Dihydrate Complex;
boron trifluoride dihydrate;
Boron phosphate;
AKOS BBB/074;
2-Bromo-4-nitrobenzenamine;
2-BROMO-4-NITROANILINE;
Borane dimethyl sulfide;
boron trihydride sulfanediyldimethane (1:1);
(methylsulfanyl)methane-borane (1:1);
Borane-methylsulfide complex;
Dimethylsulfide borane complex;
Borane-methyl sulfide complex;
Rifaprodin;
Rifater;
Rifobac;
Rifoldin;
Riforal;
Rimactan;
Rimycin;
Rifamycin SV Sodium;
Rifandin;
(2S,12Z,14E,16S,17S,18R,19R,20R,21S,22R,23S,24E)-5,6,9,17,19-pentahydroxy-23-methoxy-2,4,12,16,18,20,22-heptamethyl-8-{(E)-[(4-methylpiperazin-1-yl)imino]methyl}-1,11-dioxo-1,2-dihydro-2,7-(epoxypentadeca[1,11,13]trienoimino)naphtho[2,1-b]furan-21-yl acet;
rifampicin;
Milmer;
Milmer 1;
Oxine-copper;
Copper 8-quinolinolate;
copper(2+) 8-hydroxyoctahydro-2H-quinolin-1-ide 8-hydroxy-2H-quinolin-1-ide (1:1:1);
quinolin-8-ol - copper (2:1);
copper(2+) diquinolin-8-olate;
copper(2+) bis(8-hydroxyquinoline-2-carboxylate);
8-Quinolate;
8-hydroxyquinolin
英文别名：
(5-Methyl-2-phenyl-2H-1,2,3-triazol-4-yl)methanol;
(5-methyl-2-phenyltriazol-4-yl)methanol
精确分子量/精确质量：
189.09000
极性分子表面积/PSA：
50.94000
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。
InChI：
InChI=1/C10H11N3O/c1-8-10(7-14)12-13(11-8)9-5-3-2-4-6-9/h2-6,14H,7H2,1H3

物化性质展开↓

密度：
1.23g/cm3
熔点：
75ºC
沸点：
392ºC at 760mmHg
闪点：
190.9ºC
折射率：
1.626
蒸汽压：
7.58E-07mmHg at 25°C

安全信息展开↓

海关代码：
2933990090
安全说明：
S24/25

合成路线查看所有的合成路线

  • 127-08-2

    乙酸钾

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  • 145324-77-2

    145324-77-2

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    ~87%

  • 13322-19-5

    (5-甲基-2-苯基-2H-1,2,3-噻唑-4-基)甲醇

  • +

  • 145324-78-3

    4-methoxymethyl-5-methyl-2-phenyl-1,2,3-triazole

  • 15256-65-2

    2H-1,2,3-Triazole, 4,5-dimethyl-2-phenyl-, 1-oxide

  • →

  • 58737-90-9

    4,5-dimethyl-2-phenyltriazole

  • +

  • 13322-19-5

    (5-甲基-2-苯基-2H-1,2,3-噻唑-4-基)甲醇

  • 15256-65-2

    2H-1,2,3-Triazole, 4,5-dimethyl-2-phenyl-, 1-oxide

  • →

  • 13322-19-5

    (5-甲基-2-苯基-2H-1,2,3-噻唑-4-基)甲醇

MSDS 展开↓

Name: (5-Methyl-2-phenyl-2h-1 2 3-triazol-4-yl)methanol 97% Material Safety Data Sheet
Synonym: 5-Hydroxymethyl-4-methyl-2-phenyl-1,2,3-triazol
CAS: 13322-19-5
Section 1 - Chemical Product   MSDS Name:(5-Methyl-2-phenyl-2h-1 2 3-triazol-4-yl)methanol 97% Material Safety Data Sheet
Synonym:5-Hydroxymethyl-4-methyl-2-phenyl-1,2,3-triazol
Section 2 - COMPOSITION, INFORMATION ON INGREDIENTS
CAS# Chemical Name content EINECS#
13322-19-5 (5-Methyl-2-phenyl-2H-1,2,3-triazol-4- 97% unlisted
Hazard Symbols: None Listed.
Risk Phrases: None Listed.
Section 3 - HAZARDS IDENTIFICATION
  EMERGENCY OVERVIEW
Not available.
Potential Health Effects
Eye:
May cause eye irritation.
Skin:
May cause skin irritation. May be harmful if absorbed through the skin.
Ingestion:
May cause irritation of the digestive tract. May be harmful if swallowed.
Inhalation:
May cause 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.
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 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 cool, dry place. Store in a tightly closed container.
Section 8 - EXPOSURE CONTROLS, PERSONAL PROTECTION
  Engineering Controls:
Use adequate ventilation to keep airborne concentrations low.
Exposure Limits CAS# 13322-19-5: 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: Solid
Color: off-white
Odor: Not available.
pH: Not available.
Vapor Pressure: Not available.
Viscosity: Not available.
Boiling Point: Not available.
Freezing/Melting Point: 74 - 76 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:
Specific Gravity/Density:
Molecular Formula: C10H11N3O
Molecular Weight: 189.22
Section 10 - STABILITY AND REACTIVITY
  Chemical Stability:
Not available.
Conditions to Avoid:
Incompatible materials.
Incompatibilities with Other Materials:
Strong oxidizing agents, acid chlorides.
Hazardous Decomposition Products:
Nitrogen oxides, carbon monoxide, carbon dioxide.
Hazardous Polymerization: Not available.
Section 11 - TOXICOLOGICAL INFORMATION
  RTECS#:
CAS# 13322-19-5 unlisted.
LD50/LC50:
Not available.
Carcinogenicity:
(5-Methyl-2-phenyl-2H-1,2,3-triazol-4-yl)methanol - Not listed by ACGIH, IARC, or NTP.
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: Not available.
Risk Phrases:
Safety Phrases:
S 24/25 Avoid contact with skin and eyes.
WGK (Water Danger/Protection)
CAS# 13322-19-5: No information available.
Canada
None of the chemicals in this product are listed on the DSL/NDSL list.
CAS# 13322-19-5 is not listed on Canada's Ingredient Disclosure List.
US FEDERAL
TSCA
CAS# 13322-19-5 is not listed on the TSCA inventory.
It is for research and development use only.

SECTION 16 - ADDITIONAL INFORMATION
N/A

海关数据查看详细

中国海关编码：2933990090

概述：
2933990090. 其他仅含氮杂原子的杂环化合物. 增值税率:17.0%. 退税率:13.0%. 监管条件:无. 最惠国关税:6.5%. 普通关税:20.0%
申报要素：
品名, 成分含量, 用途, 乌洛托品请注明外观, 6－己内酰胺请注明外观, 签约日期
摘要/Summary：
2933990090. heterocyclic compounds with nitrogen hetero-atom(s) only. VAT:17.0%. Tax rebate rate:13.0%. . MFN tariff:6.5%. General tariff:20.0%

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