24085-03-8 (沙丁胺醇杂质E,N-Benzyl Albuterol)

快速询单

结构式：

沙丁胺醇杂质EMOL文件

CAS号：

24085-03-8

中文名称：

沙丁胺醇杂质E

英文名称：

N-Benzyl Albuterol

分子式：

C₂₀H₂₇NO₃

分子量：

329.433285951614

API：

Salbutamol

沙丁胺醇杂质E(24085-03-8)名称与标识符

名称

中文别名：

(S)-9-羟基利培酮;4-(2-(苄基(叔丁基)氨基)-1-羟基乙基)-2-(羟甲基)苯酚;硫酸沙丁胺醇杂质E(EP) 标准品;沙丁胺醇杂质E;alpha1-[[(叔丁基)(苄基)氨基]甲基]-4-羟基-1,3-苯二甲醇;

英文别名：

1,3-Benzenedimethanol, a1-[[(1,1-dimethylethyl)(phenylmethyl)amino]methyl]-4-hydroxy-;N-Benzyl Albuterol;1-(4-hydroxy-3-hydroxymethylphenyl)-2-(terbutyl-N-benzylamine)Ethanol;4-[2-[benzyl(tert-butyl)amino]-1-hydroxyethyl]-2-(hydroxymethyl)phenol;alpha-[(benzyl-tert-butylamino)methyl]-m-xylene-4,alpha,alpha'-triol;EINECS 246-013-7;α1-[[(1,1-Dimethylethyl)(phenylmethyl)amino]methyl]-4-hydroxy-1,3-benzenedimethanol;(1RS)-2-[Benzyl(1,1-dimethylethyl)amino]-1-[4-hydroxy-3-(hydroxymethyl)phenyl]ethanol;Salbutamol impurity E (PhEur);UNII-5H8WJ8C1XR;N-BENZYLALBUTEROL;SALBUTAMOL SULFATE IMPURITY E [EP IMPURITY];(+/-)-N-BENZYL ALBUTEROL;EC 246-013-7;NS00005855;N-BENZYL ALBUTEROL, (+/-)-;Q27262184;(1RS)-2-(BENZYL(1,1-DIMETHYLETHYL)AMINO)-1-(4-HYDROXY-3-(HYDROXYMETHYL)PHENYL)ETHANOL;24085-03-8;DTXSID80865134;CCRIS 3458;1-(4'-Hydroxy-3'-hydroxymethylphenyl)-2-(benzyl-tert-butylamino)ethanol;FT-0662670;.ALPHA.1-BENZYL-TERT-BUTYLAMINOMETHYL-4-HYDROXY-M-XYLENE-.ALPHA.1,.ALPHA.3-DIOL;SCHEMBL3825235;alpha-((Benzyl-tert-butylamino)methyl)-m-xylene-4,alpha,alpha'-triol;Salbutamol EP Impurity E;1,3-BENZENEDIMETHANOL, .ALPHA.1-(((1,1-DIMETHYLETHYL)(PHENYLMETHYL)AMINO)METHYL)-4-HYDROXY-;SALBUTAMOL IMPURITY E [EP IMPURITY];M-XYLENE-.ALPHA.,.ALPHA.'-DIOL, .ALPHA.1-((BENZYL-TERT-BUTYLAMINO)METHYL)-4-HYDROXY-;4-(2-(BenZyl(tert-butyl)amino)-1-hydroxyethyl)-2-(hydroxymethyl)phenol;SalbutamolEPImpurityE;N-BENZYL SALBUTAMOL;.ALPHA.1-(((1,1-DIMETHYLETHYL)(PHENYLMETHYL)AMINO)METHYL)-4-HYDROXY-1,3-BENZENEDIMETHANOL;1-(4'-hydroxy-3'-hydroxymethyl phenyl)-2-(benzyl-tert-butylamino)ethanol;5H8WJ8C1XR;MFCD02751869;alpha1-[[(1,1-Dimethylethyl)(phenylmethyl)amino]methyl]-4-hydroxy-1,3-benzenedimethanol;DB-369794;ALPHA1-(((1,1-DIMETHYLETHYL)(PHENYLMETHYL)AMINO)METHYL)-4-HYDROXY-1,3-BENZENEDIMETHANOL;ALPHA1-BENZYL-TERT-BUTYLAMINOMETHYL-4-HYDROXY-M-XYLENE-ALPHA1,ALPHA3-DIOL;1,3-BENZENEDIMETHANOL, ALPHA1-(((1,1-DIMETHYLETHYL)(PHENYLMETHYL)AMINO)METHYL)-4-HYDROXY-;DTXCID80813579;SALBUTAMOL SULFATE IMPURITY E (EP IMPURITY);M-XYLENE-ALPHA,ALPHA'-DIOL, ALPHA1-((BENZYL-TERT-BUTYLAMINO)METHYL)-4-HYDROXY-;SALBUTAMOL IMPURITY E (EP IMPURITY);

标识符

MDL：

MFCD02751869

InChIKey：

NZBXAYHLQSMNQS-UHFFFAOYSA-N

Inchi：

1S/C20H27NO3/c1-20(2,3)21(12-15-7-5-4-6-8-15)13-19(24)16-9-10-18(23)17(11-16)14-22/h4-11,19,22-24H,12-14H2,1-3H3

SMILES：

OC(C1C=CC(=C(CO)C=1)O)CN(CC1C=CC=CC=1)C(C)(C)C

沙丁胺醇杂质E(24085-03-8)物化性质

实验特性

LogP : 3.21860
PSA : 63.93000
折射率 : 1.6
沸点 : 496°C at 760 mmHg
闪点 : 249.6°C
溶解度 : Very 微溶 (0.56 g/L) (25 ºC),
密度 : 1.162±0.06 g/cm3 (20 ºC 760 Torr),

计算特性

精确分子量 : 329.19900
氢键供体数量 : 3
氢键受体数量 : 4
可旋转化学键数量 : 7
同位素质量 : 329.199
重原子数量 : 24
复杂度 : 362
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 : 1
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） : 2.9
互变异构体数量 : 3
表面电荷 : 0
拓扑分子极性表面积 : 63.9A^2

沙丁胺醇杂质E(24085-03-8)安全信息

安全说明： H303+H313+H333
危险品运输编号： NONH for all modes of transport
危害声明：H303吞入可能有害+H313皮肤接触可能有害+H333吸入可能对身体有害
警示性声明：P264+P280+P305+P351+P338+P337+P313
储存条件： Store at recommended temperature
信号词： warning

沙丁胺醇杂质E(24085-03-8)国际标准相关数据

EINECS：

246-013-7

沙丁胺醇杂质E(24085-03-8)海关数据

海关编码：

2922509090

海关数据：

中国海关编码：

2922509090

概述：

2922509090. 其他氨基醇酚、氨基酸酚及其他含氧基氨基化合物. 增值税率:17.0%. 退税率:13.0%. 监管条件：AB. 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, 乙醇胺及其盐应报明色度, 乙醇胺及其盐应报明包装

监管条件：

A.入境货物通关单
B.出境货物通关单

检验检疫类别：

R.进口食品卫生监督检验
S.出口食品卫生监督检验

Summary：

2922509090. other amino-alcohol-phenols, amino-acid-phenols and other amino-compounds with oxygen function. VAT:17.0%. Tax rebate rate:13.0%. . MFN tariff:6.5%. General tariff:30.0%

沙丁胺醇杂质E(24085-03-8)推荐厂家更多厂家(20)

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上海柯维化学技术有限公司	18901607656 021-64609169	白荷	3428632096	询单
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上海瀚思化工有限公司	18939883912 021-34536277	顾经理	3003949364	询单
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沙丁胺醇杂质E(24085-03-8)参考资料

Reaxys RN：

PubChem CID：

91122

沙丁胺醇杂质E(24085-03-8) MSDS

基础信息

Name:	1-(4-Hydroxy-3-hydroxymethylphenyl)-2-(tert-butylbenzylamino)ethanol Material Safety Data Sheet
Synonym:
CAS:	24085-03-8

Section 1 - Chemical Product ? MSDS Name:1-(4-Hydroxy-3-hydroxymethylphenyl)-2-(tert-butylbenzylamino)ethanol Material Safety Data Sheet
Synonym:

Section 2 - COMPOSITION, INFORMATION ON INGREDIENTS

CAS#	Chemical Name	content	EINECS#
24085-03-8	1-(4-Hydroxy-3-hydroxymethylphenyl)-2-		246-013-7

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 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:
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# 24085-03-8: 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: Crystalline powder
Color: white
Odor: Not available.
pH: Not available.
Vapor Pressure: Not available.
Viscosity: Not available.
Boiling Point: Not available.
Freezing/Melting Point: 114 - 118 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: C20H27NO3
Molecular Weight: 329.44

Section 10 - STABILITY AND REACTIVITY
? Chemical Stability:
Stable under normal temperatures and pressures.
Conditions to Avoid:
Incompatible materials.
Incompatibilities with Other Materials:
Strong oxidizing agents.
Hazardous Decomposition Products:
Nitrogen oxides, carbon monoxide, carbon dioxide.
Hazardous Polymerization: Will not occur.

Section 11 - TOXICOLOGICAL INFORMATION
? RTECS#:
CAS# 24085-03-8 unlisted.
LD50/LC50:
Not available.
Carcinogenicity:
1-(4-Hydroxy-3-hydroxymethylphenyl)-2-(tert-butylbenzylamino)ethanol - 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
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: 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# 24085-03-8: No information available.
Canada
None of the chemicals in this product are listed on the DSL/NDSL list.
CAS# 24085-03-8 is not listed on Canada's Ingredient Disclosure List.
US FEDERAL
TSCA
CAS# 24085-03-8 is not listed on the TSCA inventory.
It is for research and development use only.

SECTION 16 - ADDITIONAL INFORMATION
N/A