Sec-Butylbenzene 仲丁基苯

CAS 135-98-8 MFCD00009329

化学结构图

135-98-8
SMILES: CCC(C)c1ccccc1

化学属性

Mol. FormulaC6H5CH(CH3)CH2CH3
Mol. Weight134
Refractive index1.4890 to 1.4910
Boiling Point173 - 174
Density0.863
Melting Point-76
Flash Point52°C(lit.)
TSCAYes
Autoignition Point784 °F
Vapor Pressure4 mmHg ( 37.7 °C)
Solubility不溶于水，溶于乙醇等多数有机溶剂。

别名和识别编码

Chemical NameSec-Butylbenzene
Synonym SEC-BUTYLBENZENE (2-butyl)benzene Benzene, (1-methylpropyl)-, (±)- SEC-BUTYLBENZENE, STANDARD FOR GC sec-Butylbenzene 另丁基苯 Secondary butylbenzene sec-butyl-benzen 第二丁基苯 Benzene,(1-methylpropyl)- sec-butyl-benzene sek.-Butylbenzol (1-methylpropyl)-benzen (1-methylpropyl)benzene sek-Butylbenzol benzene, (1-methylpropyl)- 异丁基苯 sek. Butylbenzol sec-butylbenzene solution 仲丁苯 2-苯基丁烷 2-phenylbutane 1-methylpropylbenzene sec-butylbenzene sec.-Butylbenzol #nsec.-Butylbenzene SEC-BUTYLBENZENE, 99+% 仲丁基苯 (RS)-2-Phenylbutane 仲丁苯,(1-甲基丙基)苯,2-苯基丁烷,另丁基苯,第二丁基苯 (α-Methylpropyl)benzene 2-Phenylbutane (1-Methylpropyl)benzene (±)-sec-Butylbenzene Butylbenzene, sec-: (2-Phenylbutane) Benzene, sec-butyl- 1-Methylpropylbenzol S-BUTYL BENZENE Benzene, sec-butyl- benzene,(1-methylpropyl-) (±)-2-phenyl-butane 2-PHENYLBUTANE sec butylbenzene (1-甲基丙基)苯 仲丁基苯;仲丁苯;(1-甲基丙基)苯;2-苯基丁烷;另丁基苯;第二丁基苯 SEC-BUTYLBENZENE, 1X1ML, MEOH, 5000UG/ML sek-Butylbenzen (1-METHYLPROPYL)BENZENE Benzene, (1-methylpropyl)- 仲丁(基)苯 sec.-Butylbenzol sec-Butylbenzene (1mg/ml in Methanol) [for Water Analysis]
CAS Number135-98-8
PubChem Substance ID8680
EC Number205-227-0
Beilstein Registry Number1903902
MDL NumberMFCD00009329
Reaxys-RN1903902
Merck Number1550
Chemical Name Translation仲丁基苯
Wiswesser Line Notation2Y1&R
LabNetwork Molecule IDLN00196134
InChIInChI=1S/C10H14/c1-3-9(2)10-7-5-4-6-8-10/h4-9H,3H2,1-2H3
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分类

  • {SNA} Arenes, Building Blocks,
  • A-B, Alpha Sort, Alphabetic, Analytical Standards, Analytical/Chromatography, Aromatics, B, BI - BZ, Chemical Class, Chromatography, Environmental Standards,
  • {SA} A-B, Alpha Sort, Alphabetic, Analytical Standards, Analytical/Chromatography, Aromatics, B, BI - BZ, Chemical Class, Chromatography, Environment
  • {SNA} Arenes, Building Blocks, Chemical Synthesis, Organic Building Blocks
  • {SNA} Arenes,
  • {SNA} A-B,

产品应用

  • 用于有机合成；溶剂。

相关文献及参考

  • Merck: 14,1550
  • Short: IV/10A
  • Merck: 14,1550 Beilstein: 5,IV,1038
  • Short: III/38B

安全信息

GHS Symbol
WGK Germany3
Hazard statements
  • H226 Flammable liquid and vapour 易燃液体和蒸气
  • H315 Causes skin irritation 会刺激皮肤
  • H225 Highly flammable liquid and vapour 高度易燃液体和蒸气
Personal Protective Equipment Eyeshields, Faceshields, full-face respirator (US), Gloves, multi-purpose combination respirator cartridge (US), type ABEK (EN14387) respirator filter
RTECSCY9100000
Signal word Warning {} {} {} {} {} {} {} {} {} {TCI}
UN Number 2709 UN 2709 3/PG 3 UN2709
Precautionary statements
  • P264 Wash hands thoroughly after handling. 处理后要彻底洗净双手。
  • P271 Use only outdoors or in a well-ventilated area.? 只能在室外或通风良好的地方使用。
  • P273 Avoid release to the environment. 避免释放到环境中。
  • P280 Wear protective gloves/protective clothing/eye protection/face protection. 戴防护手套/防护服/眼睛的保护物/面部保护物。
  • P301+P312+P330
  • P302+P352+P332+P313+P362+P364
  • P303+P361+P353
  • P332+P313
  • P337+P313
  • P362 Take off contaminated clothing and wash before reuse. 脱掉污染的衣服，清洗后方可重新使用
  • P391 Collect spillage. Hazardous to the aquatic environment 收集对水环境有危害的泄漏物。
  • P403+
  • P403+P235
  • P501 Dispose of contents/container to..… 处理内容物/容器.....
Risk Statements
  • R10 Flammable 易燃
  • R11 Highly flammable 非常易燃
  • R23/24/25 Toxic by inhalation, in contact with skin and if swallowed 吸入，皮肤接触及吞食都有毒
  • R38 Irritating to skin 刺激皮肤
  • R39/23/24/25 Toxic: danger of very serious irreversible effects through inhalation, in contact with skin and if swallowed 毒性：吸入，皮肤接触和吞食都会产生十分严重的不可逆危险
  • R51/53
Safety Statements
  • S16 Keep away from sources of ignition - No smoking 远离火源，禁止吸烟；
  • S23 Do not breathe gas/fumes/vapour/spray (appropriate wording to be specified by the manufacturer) 不要吸入气体/烟雾/蒸汽/喷雾；
  • S24/25 Avoid contact with skin and eyes 避免皮肤和眼睛接触；
  • S26 In case of contact with eyes, rinse immediately with plenty of water and seek medical advice 眼睛接触后，立即用大量水冲洗并征求医生意见；
  • S36/37 Wear suitable protective clothing and gloves 穿戴适当的防护服和手套；
  • S45 In case of accident or if you feel unwell seek medical advice immediately (show the label where possible) 发生事故时或感觉不适时，立即求医（可能时出示标签）；
  • S61 Avoid release to the environment. Refer to special instructions/safety data sheet 避免释放到环境中，参考特别指示/安全收据说明书；
  • S7 Keep container tightly closed 保存在严格密闭容器中；
Packing GroupIII
Hazard Codes 3 F,T Xi,N
Hazard Class3
Storage condition 储存温度2-8℃ 2-8°C
Warnings 危化品目录(2015) 危险化学品 
TYPE OF TEST            : LD50 - Lethal dose, 50 percent kill
ROUTE OF EXPOSURE       : Administration onto the skin
SPECIES OBSERVED        : Rodent - rabbit
DOSE/DURATION           : >16 mL/kg
TOXIC EFFECTS :
   Details of toxic effects not reported other than lethal dose value
REFERENCE :
   TXAPA9 Toxicology and Applied Pharmacology.  (Academic Press, Inc., 1 E.
   First St., Duluth, MN 55802) V.1-    1959-  Volume(issue)/page/year:
   28,313,1974

TYPE OF TEST            : LD50 - Lethal dose, 50 percent kill
ROUTE OF EXPOSURE       : Oral
SPECIES OBSERVED        : Rodent - rat
DOSE/DURATION           : 2240 uL/kg
TOXIC EFFECTS :
   Details of toxic effects not reported other than lethal dose value
REFERENCE :
   TXAPA9 Toxicology and Applied Pharmacology.  (Academic Press, Inc., 1 E.
   First St., Duluth, MN 55802) V.1-    1959-  Volume(issue)/page/year:
   28,313,1974

其他信息

  • 毒性分级:中毒
  • 能与醚；醇；苯混溶，不溶于水
  • 蒸气压:4 mm Hg ( 37.7 °C)
  • {Chemi
  • 刺激数据:皮肤- 兔子 100 毫克/ 24小时 中度; 眼- 兔子 500 毫克/ 24小时 轻度
  • 爆炸物危险特性:与空气混合可爆
  • 灭火剂:泡沫、干粉、二氧化碳
  • 上游原料:苯 --> 正丁醇 --> 五氧化二磷 --> 无水苯 --> 三氟化硼
  • 可燃性危险特性:遇明火、高温、强氧化剂可燃; 燃烧排放刺激烟雾
  • 图谱信息:仲丁基苯 (135-98-8)核磁图( 13 CNMR) 仲丁基苯 (135-98-8)核磁图( 1 HNMR) 仲丁基苯 (135-98-8)红外图谱(IR1) 仲丁基苯 (135-98-8)质谱(MS)
  • 挥发性有机化合物(VOCs)单组分标准液
  • Sigma Aldrich:135-98-8(sigmaaldrich)
  • 方法一:由苯与仲丁基氯反应而得。将无水苯和无水的氯化铝搅拌冷却，在0-5℃滴加仲丁基氯，加完后继续搅拌反应1h。搅拌下加入冷水，将反应混合物进行水蒸气蒸馏。馏出液分去水，干燥后再分馏，收集171-173℃馏分即得成品，产率77%。
  • MSDS 信息:异丁基苯(135-98-8).msds
  • 类别:可燃物品
  • 储运特性:包装完整、轻装轻卸; 库房通风、远离
  • Acros Organics:仲
  • 储运特性:包装完整、轻装轻卸;
  • {Chemicalbook
  • 用途一:用于有机合成；溶剂。
  • 急性毒性:口服- 大鼠 LD50: 2240 微升/ 公斤
  • 能
  • Alfa Aesar:仲丁基苯,99% sec-Butylbenzene, 99%(135-98-8)
  • MOL 文件:135-98-8.mol
  • TCI Shanghai:仲丁基苯(1mg/ml的甲醇溶液)[用于水分析] sec-Butylbenzene (1mg/ml in Methanol) [for Water Analysis](135-98-8)
  • 能与醚；醇；苯混溶，不溶于水。

系列性分类

  1. Chemical Synthesis 化学合成
  2. Building Blocks 合成砌块
  3. Organic Building Blocks 有机砌块
  4. Arenes 芳烃
  1. Chemical Synthesis 化学合成
  2. Building Blocks 合成砌块
  3. Chemicals by Class 化学分类法
  4. Hydrocarbons - Chemical Class
  5. Neats - Hydrocarbons
  1. Analytical & Chromatography 分析化学与色谱
  2. Analytical Standards
  3. Alphabetic - Analytical Standards
  4. B - Alphabetic
  5. BI - BZ - B
  1. Chemical Synthesis 化学合成
  2. Building Blocks 合成砌块
  3. Organic Building Blocks 有机砌块
  4. Alkynes 炔

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