Syringaldehyde 丁香醛

CAS 134-96-3 MFCD00006943

化学结构图

134-96-3
SMILES: COc1cc(C=O)cc(OC)c1O

化学属性

Mol. FormulaC9H10O4
Mol. Weight182.17
Boiling Point192-193°C at 760 mmHg
Melting Point110-113°C
Density1.013
TSCAYes
SolubilityVERY 微溶
Stability对光敏感
Flash Point192-193°C/14mm

别名和识别编码

Chemical NameSyringaldehyde
Synonym Syringaldehyde {LY} Syringaldehyde {} {LY} Syringaldehyde {} {} {LY} Syringaldehyde {} {} {} {LY} Syringaldehyde {} {} {} {} {LY} Syringaldehyde {} {} {} {} {} {LY} Syringaldehyde {} {} {} {} {} {} {LY} Syringaldehyde {} {} {} {} {} {} {} {LY} Syringaldehyde {} {} {} {} {} {} {} {} {LY} Syringaldehyde {} {} {} {} {} {} {} {} {} { {} {} {} {} {} {} {} {} {} {LY} Syringaldehyde {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {LY} Syringaldehyde {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {LY} Syringaldehyde {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} { {} {} {} {} {} {} {} {} {} {} {} {} {LY} Syringaldehyde {} {} {} {} {} {} {} {} {} {} {} {} {} {LY} Syringaldehyde {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} { {} {} {} {} {} {} {} {} {} {} {} {} {} {} {LY} Syringaldehyde {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} { {} {} {} {} {} {} {} {} {} {} {} {} {} {
CAS Number134-96-3
PubChem Substance ID8655
EC Number205-167-5
Beilstein Registry Number8,391
MDL NumberMFCD00006943
Reaxys-RN784514
Merck Number14,9015
Chemical Name Translation丁香醛
Wiswesser Line NotationVHR DQ CO1 EO1
LabNetwork Molecule IDLN00193892
InChIInChI=1S/C9H10O4/c1-12-7-3-6(5-10)4-8(13-2)9(7)11/h3-5,11H,1-2H3
Canonical SMILESO=CC1=CC(OC)=C(O)C(OC)=C1
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分类

  • {SNA} Alphabetical Listings, Flavors and Fragrances, Q-Z
  • {SNA} Alphabetical Listings, Certified Food Grade Products, Flavors and Fragrances, Q-Z, R-Z
  • {uni_hamburg} no charge; carbocycle; aromatic; 6RingOnly; 6ring; aldehyde; alcohol; ether; 1fragment
  • Aldehydes, Building Blocks, C9, Carbonyl Compounds, Chemical Synthesis,

相关文献及参考

  • Merck: 14,9015
  • Short: EINECS
  • Merck: 14,9015 Beilstein:8,391
  • Short: III/35C1

安全信息

GHS Symbol
WGK Germany3
Hazard statements
  • H302 Harmful if swallowed 吞食有害
  • H315 Causes skin irritation 会刺激皮肤
  • H319 Causes serious eye irritation 严重刺激眼睛
  • H335 May cause respiratory irritation 可能导致呼吸道刺激
Personal Protective Equipment dust mask type N95 (US), Eyeshields, Gloves
Hazard Codes Xn Xn,Xi Xi
RTECSCU5760000
Precautionary statements
  • P261 Avoid breathing dust/fume/gas/mist/vapours/spray. 避免吸入粉尘/烟/气体/烟雾/蒸汽/喷雾。
  • P264 Wash hands thoroughly after handling. 处理后要彻底洗净双手。
  • P264+P265
  • P270 Do not eat, drink or smoke when using this product. 使用本产品时不要吃东西，喝水或吸烟。
  • 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。
  • 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
  • P301+P317
  • P302+P352
  • P302+P352+P332+P313+P362+P364
  • P304+P340
  • P305+P351+P338
  • P305+P351+P338+P337+P313
  • P312 Call a POISON CENTER or doctor/physician if you feel unwell. 如果你感觉不适，呼叫解毒中心或医生/医师。
  • P319
  • P321 Specific treatment (see … on this label). 具体治疗（见本标签上的）。
  • P330 Rinse mouth. 漱口
  • P332+P313
  • P332+P317
  • P337+P313
  • P337+P317
  • 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
  • P362+P364
  • P403+P233
  • P405 Store locked up. 上锁保管。
  • P501 Dispose of contents/container to..… 处理内容物/容器.....
Signal word
Safety Statements
Risk Statements
  • R36/37/38 Irritating to eyes, respiratory system and skin 对眼睛、呼吸系统和皮肤有刺激性
Storage condition 2-8°C, stored under nitrogen {LY} 2-8°C, stored under nitrogen Air Sensitive {} {LY} 2-8°C, stored under nitrogen {} {} {LY} 2-8°C, stored under nitrogen {} {} {} {LY} 2-8°C, stored under nitrogen {} {} {} {} {LY} 2-8°C, stored under nitrogen {} {} {} {} {} {LY} 2-8°C, stored under nitrogen {} {} {} {} {} {} {LY} 2-8°C, stored under nitrogen {} {} {} {} {} {} {} {LY} 2-8°C, stored under nitrogen {} {} {} {} {} {} {} {} { {} {} {} {} {} {} {} {} {LY} 2-8°C, stored under nitrogen {} {} {} {} {} {} {} {} {} {LY} 2-8°C, stored under nitrogen {} {} {} {} {} {} {} {} {} {} {LY} 2-8°C, stored under nitrogen {} {} {} {} {} {} {} {} {} {} {} {LY} 2-8°C, stored under nitrogen {} {} {} {} {} {} {} {} {} {} {} {} {LY} 2-8°C, stored under nitrogen {} {} {} {} {} {} {} {} {} {} {} {} {} {LY} 2-8°C, stored under nitrogen {} {} {} {} {} {} {} {} {} {} {} {} {} {} {LY} 2-8°C, stored under nitrogen {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {LY} 2-8°C, stored under nitro 
TYPE OF TEST            : LD50 - Lethal dose, 50 percent kill
ROUTE OF EXPOSURE       : Intraperitoneal
SPECIES OBSERVED        : Rodent - mouse
DOSE/DURATION           : 1 gm/kg
TOXIC EFFECTS :
   Behavioral - altered sleep time (including change in righting reflex)
REFERENCE :
   JMCMAR Journal of Medicinal Chemistry.  (American Chemical Soc.,
   Distribution Office Dept. 223, POB POB 57136, West End Stn., Washington, DC
   20037)  V.6-    1963-  Volume(issue)/page/year: 7,178,1964

其他信息

  • 海关编码:29124900
  • Acros Organics:3，5-二甲氧基-4-羟基苯甲醛 3,5-Dimethoxy-4-hydroxybenzaldehyde, 98%(134-96-3)
  • Sigma Aldrich:134-96-3(sigmaaldrich)
  • 敏感性:Air Sensitive
  • 丁香醛价格(试剂级):更新日期 产品编号 产品名称 包装 价格 2014/06/02 D0635 丁香醛 Syringaldehyde 100G 1780元 2014/06/02 D0635 丁香醛 Syringaldehyde 1G 124元 2014/06/02 D0635 丁香醛 Syringaldehyde 25G 599元
  • MOL 文件:134-96-3.mol
  • FEMA:4049
  • MSDS 信息:3,5-Dimethoxy-4-hydroxybenzaldehyde(134-96-3).msds
  • Hazard Note:Irritant
  • 溶于乙醇、乙醚、氯仿、热苯、乙酸，微溶于水和石油醚；
  • 图谱信息:丁香醛(134-96-3)红外图谱(IR1) 丁香醛(134-96-3)质谱(MS) 丁香醛(134-96-3)核磁图( 13 CNMR) 丁香醛(134-96-3)核磁图( 1 HNMR) 丁香醛(134-96-3)红外图谱(IR2)
  • TCI Shanghai:3,5-二甲氧基-4-羟基苯甲酸 Syringaldehyde,>;98.0%(LC)(T)(134-96-3)
  • 上游原料:盐酸 --> 吡啶 --> 六氢吡啶 --> 3,4,5-三甲氧基苯甲醛
  • Alfa Aesar:丁香醛;3,5-二甲氧基-4-羟基苯甲醛,98+% Syringaldehyde, 98+%(134-96-3)

系列性分类

  1. Application Areas 应用领域分类
  2. Flavors and Fragrances 香精香料
  3. Alphabetical Listings - Flavors and Fragrances
  4. Q-Z - Alphabetical Listings
  1. Chemical Synthesis 化学合成
  2. Building Blocks 合成砌块
  3. Organic Building Blocks 有机砌块
  4. Carbonyl Compounds 羰基化合物
  5. Aldehydes - Carbonyl Compounds
  6. C9 - Aldehydes
  1. Chemical Synthesis 化学合成
  2. Building Blocks 合成砌块
  3. Organic Building Blocks 有机砌块
  4. Carbonyl Compounds 羰基化合物
  5. Aromatic aldehyde<including acetal,hemiacetal>
  1. Chemical Synthesis 化学合成
  2. Building Blocks 合成砌块
  3. Organic Building Blocks 有机砌块
  4. Carbonyl Compounds 羰基化合物
  5. Aldehydes
  6. C8