2-Methoxybenzoic acid 2-甲氧基苯甲酸

CAS 579-75-9 MFCD00002431

化学结构图

579-75-9
SMILES: COc1ccccc1C(=O)O

化学属性

Mol. FormulaC8H8O3
Mol. Weight152.15
Density1.422
Melting Point98-100°C
TSCAYes
Appearance 白色薄片状结晶。熔点106℃(101℃),沸点200℃。易溶于乙醇、乙醚、氯仿,溶于苯和四氯化碳。在30℃时可溶于200份水中,较易溶于热水。 白色或微红色结晶状粉末。熔点163-164℃。能随水蒸气同时挥发。易溶于热水,能溶于醇、醚、氯仿及氢氧化钠溶液,微溶于冷水。
Solubility1.5 g/L (20 °C)
Boiling Point279.9°C at 760 mmHg

别名和识别编码

Chemical Name2-Methoxybenzoic Acid
Synonym O-ANISIC ACID 99+% 2-甲氧基苯甲酸 O-Methylsalicylic acid AKOS BBS-00003735 O-METHOXYBENZOIC ACID 2-hydroxy-3-methyl-benzoicaci 2-methylsalicylicacid O-METHYLSALICYLIC ACID 3-甲基邻羟基苯甲酸 2-甲氧基苯甲酸 O-甲基水杨酸 邻茴香酸 2-Methoxybenzoic acid, 98+% 柳酸甲醚 2-甲氧基苯甲酸; 邻甲氧基苯甲酸 acidoortocresotinico FEMA 3943 2-Methoxybenzoic Acid/o-Methoxybenzoic Acid 水杨酸甲醚 o-anisic salicylicacidmethylether 2,3-Cresotic acid 2-METHOXYBENZOIC ACID 2,3-cresotinicacid 3-Methylsalycilic acid Kyselina 2-methoxybenzoova 2,3-甲酚甲酸 邻甲氧基苯甲酸 Acido ortocresotinico 3-甲基-2-羟基苯甲酸 2,3-cresoticacid acido3-ossi-5-metil-benzoico 2,3-Cresotinic acid O-ANISIC ACID 3-甲基水杨酸 鄰甲氧苯甲酸 O-甲基水杨酸 邻茴香酸 2-methoxy-benzoicaci
MDL NumberMFCD00002431
CAS Number579-75-9
EC Number209-447-8
Beilstein Registry Number10(3)97
PubChem Substance ID11370
Alfabeta NameMETHOXYBENZOICACID 2-
Chemical Name Translation2-甲氧基苯甲酸
Merck Number14,2581
Reaxys-RN509929
Wiswesser Line NotationQVR BO1
LabNetwork Molecule IDLN00180457
InChIInChI=1S/C8H8O3/c1-11-7-5-3-2-4-6(7)8(9)10/h2-5H,1H3,(H,9,10)
Canonical SMILESO=C(O)C1=CC=CC=C1OC
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分类

  • {Chemicalbook} 食品添加剂: 食用香料(增香剂): 天然等同香料和人造香
  • {SA} A-B, Alphabetical Listings, Flavors and Fragrances
  • {SNA} Building Blocks, C8, Carbonyl Compounds, Carboxylic Acids, Chemical Synthesis, Organic Building Blocks

相关文献及参考

  • Birch reduction followed by in situ alkylation of the resulting anion provides an efficient synthesis of 2-alkyl-2-cyclohexenones: J. Org. Chem., 41, 2649 (1976); Org. Synth. Coll., 7, 249 (1990):
  • [1]. Meuwly P, et al. Ortho-anisic acid as internal standard for the simultaneous quantitation of salicylic acid and its putative biosynthetic precursors in cucumber leaves. Anal Biochem. 1993 Nov 1;214(2):500-5.

安全信息

Signal word Warning
GHS Symbol
WGK Germany3
Safety Statements
  • S22 Do not breathe dust 不要吸入粉尘;
  • 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;
  • S36/39 Wear suitable protective clothing and eye/face protection 穿戴适当的防护服和眼睛/面保护;
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
  • R41 Risk of serious damage to eyes 有严重损伤眼睛的危险
  • R37/38 Irritating to respiratory system and skin 对呼吸系统和皮肤有刺激性
  • R22 Harmful if swallowed 吞咽有害
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。
  • P262 Do not get in eyes, on skin, or on clothing. 不要接触眼睛,皮肤或衣服。
  • P264 Wash hands thoroughly after handling. 处理后要彻底洗净双手。
  • P264+P265
  • 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。
  • P302+P352
  • P302+P352+P332+P313+P362+P364
  • P305+P351+P338
  • P305+P351+P338+P337+P313
  • P321 Specific treatment (see … on this label). 具体治疗(见本标签上的)。
  • 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
Personal Protective Equipment Eyeshields, Gloves, type N95 (US), type P1 (EN143) respirator filter
RTECSBZ4385000
Warnings IRRITANT
Hazard Codes Xi Xn
UN Number UN 2811
Hazard statements
  • H315 Causes skin irritation 会刺激皮肤
  • H319 Causes serious eye irritation 严重刺激眼睛
TYPE OF TEST            : LDLo - Lowest published lethal dose
ROUTE OF EXPOSURE       : Intraperitoneal
SPECIES OBSERVED        : Rodent - rat
DOSE/DURATION           : 3 gm/kg
TOXIC EFFECTS :
   Behavioral - excitement
   Behavioral - muscle contraction or spasticity
REFERENCE :
   BSRSA6 Bulletin de la Societe Royale des Sciences de Liege.  (Societe Royale
   des Sciences de Liege, Universite de Liege, 15, Ave des Tilleuls, B-4000
   Liege, Belgium)  V.1-    1932-  Volume(issue)/page/year: 47,202,1978

TYPE OF TEST            : LD50 - Lethal dose, 50 percent kill
ROUTE OF EXPOSURE       : Subcutaneous
SPECIES OBSERVED        : Rodent - mouse
DOSE/DURATION           : 300 mg/kg
TOXIC EFFECTS :
   Details of toxic effects not reported other than lethal dose value
REFERENCE :
   CKFRAY Ceskoslovenska Farmacie.  (PNS-Ustredni Expedice a Dovoz Tisku,
   Kafkova 19, 160 00 Prague 6, Czechoslovakia)  V.1-    1952-
   Volume(issue)/page/year: 31,236,1982

TYPE OF TEST            : LDLo - Lowest published lethal dose
ROUTE OF EXPOSURE       : Intravenous
SPECIES OBSERVED        : Rodent - rat
DOSE/DURATION           : 2750 mg/kg
TOXIC EFFECTS :
   Behavioral - excitement
   Behavioral - muscle contraction or spasticity
REFERENCE :
   BSRSA6 Bulletin de la Societe Royale des Sciences de Liege.  (Societe Royale
   des Sciences de Liege, Universite de Liege, 15, Ave des Tilleuls, B-4000
   Liege, Belgium)  V.1-    1932-  Volume(issue)/page/year: 47,202,1978

TYPE OF TEST            : LD - Lethal dose
ROUTE OF EXPOSURE       : Intraperitoneal
SPECIES OBSERVED        : Rodent - mouse
DOSE/DURATION           : >500 mg/kg
TOXIC EFFECTS :
   Details of toxic effects not reported other than lethal dose value
REFERENCE :
   CBCCT* "Summary Tables of Biological Tests," National Research Council
   Chemical-Biological Coordination Center.  (National Academy of Science
   Library, 2101 Constitutio

Storage condition 2-8°C {LY} 2-8°C {} {LY} 2-8°C {} {} {LY} 2-8°C {} {} {} {LY} 2-8°C {} {} {} {} {LY} 2-8°C {} {} {} {} {} {LY} 2-8°C {} {} {} {} {} {} {LY} 2-8°C {} {} {} {} {} {} {} {LY} 2-8°C {} {} {} {} {} {} {} {} {LY} 2-8°C {} {} {} {} {} {} {} {} {} {LY} 2-8°C {} {} {} {} {} {} {} {} {} {} {LY} 2-8°C {} {} {} {} {} {} {} {} {} {} {} {LY} 2-8°C {} {} {} {} {} {} {} {} {} {} {} {} {LY} 2-8°C {} {} {} {} {} {} {} {} {} {} {} {} {} {LY} 2-8°C {} {} {} {} {} {} {} {} {} {} {} {} {} {} {LY} 2-8°C {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {LY} 2-8°C {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {LY} 2-8°C {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {LY} 2-8°C {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {LY} 2-8°C {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} { {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {LY} 2-8°C {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} { {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {}

其他信息

  • 邻甲氧基苯甲酸价格(试剂级):更新日期 产品编号 产品名称 包装 价格 2011/08/23 30113826 2-甲氧基苯甲酸;邻甲氧基苯甲酸;邻茴香酸;水杨酸甲
  • MOL 文件:579-75-9.mol
  • 参考质量标准:FAO/WHO,2001 含量(酸碱滴定法) ≥98% 熔点 98~99℃
  • 方法一:它的生产有固相法和溶剂法,两者相比后者不需要处理吸湿性很强的邻甲酚钠盐干粉末。反应物料系液相碳羧化反应时通CO2一次完成,不需中途蒸酚,在普通的压力设备中便能进行生产,减少了使用脱水和碳羧化设备。两种方法的生产原理是相同的。
  • MSDS 信息:2-Methoxybenzoic acid(579-75-9).msds
  • Hazard Note:Irritant
  • {Chemi
  • Acros Organics:2-甲氧基苯甲酸 o-Anisic acid, 99%(579-75-9)
  • 用途三:有机合成。防腐,消毒。
  • FEMA:3943
  • 用途二:本品可用于制造偶氮染料,特别是酸性媒介漂蓝B染料,以它为原料还可制备蓝、紫、棕、绿等三苯甲烷类媒介染料20多种。
  • MSDS 信息:Hydroxytoluic acid(83-40-9).msds
  • 使用限量:FEMA(mg/kg):焙烤制品2~5;无醇饮料1~2;含醇饮料0.5~1;冷饮0.8~1.5;软糖2.5~5。
  • 海关编码:29189090
  • Sigma Aldrich:579-75-9(sigmaaldrich)
  • Alfa Aesar:2-甲氧基苯甲酸,98+% 2-Methoxybenzoic acid, 98+%(579-75-9)
  • TCI Shanghai:2-甲氧基苯甲酸 o-Anisic Acid,>;98.0%(GC)(T)(579-75-9)
  • 毒性:GRAS(FEMA)。
  • TCI Shanghai:3-甲基水杨酸 3-Methylsalicylic Acid,>;98.0%(GC)(T)(83-40-9)
  • Sigma Aldrich:83-40-9(sigmaaldrich)
  • 图谱信息:3-甲基水杨酸(83-40-9)红外图谱(IR2) 3-甲基水杨酸(83-40-9)核磁图( 1 HNMR) 3-甲基水杨酸(83-40-9)红外图谱(IR1) 3-甲基水杨酸(83-40-9)质谱(MS) 3-甲基水杨酸(83-40-9)核磁图( 13 CNMR)
  • 检测方法:T,NMR
  • 上游原料:邻甲酚
  • 3-甲基水杨酸价格(试剂级):更新日期 产品编号 产品名称 包装 价格 2014/06/02 C0408 3-甲基水杨酸 3-Methylsalicylic Acid 25G 153元 2014/06/02 C0408 3-甲基水杨酸 3-Methylsalicylic Acid 500G 984元 2010/06/21 173341000 3-甲基水杨酸 3-Methylsalicylic acid 99% 100 GR 366元
  • 图谱信息:邻甲氧基苯甲酸(579-75-9)核磁图( 1 HNMR) 邻甲氧基苯甲酸(579-75-9)红外图谱(IR1) 邻甲氧基苯甲酸(579-75-9)红外图谱(IR2) 邻甲氧基苯甲酸(579-75-9)Raman光谱 邻甲氧基苯甲酸(579-75-9)核磁图( 13 CNMR) 邻甲氧基苯甲酸(579-75-9)质谱(MS)
  • 用途一:用于香料、医药、防腐等
  • 下游产品:媒介蓝 1 --> 邻甲氧基苯甲酸
  • Acros Organics:2-羟基-3-甲基苯甲酸 3-Methylsalicylic acid,
  • 方法一:由水杨酸与硫酸二甲酯反应而得。将水杨酸溶于氢氧化钠溶液中,冷至20℃以

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