7-(Dimethylamino)-4-methylcoumarin 7-(二甲基氨基)-4-甲基香豆素

CAS 87-01-4 MFCD00006862

化学结构图

87-01-4
SMILES: Cc1cc(=O)oc2cc(N(C)C)ccc12

化学属性

Mol. FormulaC12H13NO2
Mol. Weight203.24
Melting Point141.0 to 145.0 deg-C

别名和识别编码

Chemical Name7-(Dimethylamino)-4-methylcoumarin
Synonym 7-(Dimethylamino)-4-methylcoumarin {LY} 7-(Dimethylamino)-4-methylcoumarin {} {LY} 7-(Dimethylamino)-4-methylcoumarin {} {} {LY} 7-(Dimethylamino)-4-methylcoumarin {} {} {} {LY} 7-(Dimethylamino)-4-methylcoumarin {} {} {} {} {LY} 7-(Dimethylamino)-4-methylcoumarin {} {} {} {} {} {LY} 7-(Dimethylamino)-4-methylcoumarin {} {} {} {} {} {} {LY} 7-(Dimethylamino)-4-methylcoumarin {} {} {} {} {} {} {} {LY} 7-(Dimethylamino)-4-methylcoumarin {} {} {} {} {} {} {} {} {LY} 7-(Dimethylamino)-4-methylcoumarin {} {} {} {} {} {} {} {} {} {LY} 7-(Dimethylamino)-4-methylcoumarin {} {} {} {} {} {} {} {} {} {} { {} {} {} {} {} {} {} {} {} {} {LY} 7-(Dimethylamino)-4-methylcoumarin {} {} {} {} {} {} {} {} {} {} {} {LY} 7-(Dimethylamino)-4-methylcoumarin {} {} {} {} {} {} {} {} {} {} {} {} {LY} 7-(Dimethylamino)-4-methylcoumarin {} {} {} {} {} {} {} {} {} {} {} {} {} { {} {} {} {} {} {} {} {} {} {} {} {} {} {LY} 7-(Dimethylamino)-4-methylcoumarin {} {} {} {} {} {} {} {} {} {} {} {}
MDL NumberMFCD00006862
CAS Number87-01-4
EC Number201-717-3
Chemical Name Translation7-(二甲基氨基)-4-甲基香豆素
Reaxys-RN169992
Beilstein Registry Number18(5)11,445
PubChem Substance ID6867
Wiswesser Line NotationT66 BOVJ E1 IN1&1
InChIInChI=1S/C12H13NO2/c1-8-6-12(14)15-11-7-9(13(2)3)4-5-10(8)11/h4-7H,1-3H3
Canonical SMILESO=C1C=C(C)C2=CC=C(N(C)C)C=C2O1
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分类

  • {uni_hamburg} no charge; oxygen heterocycle; carbocycle; aromatic; large ring; fused rings; 6ring; 10ring; ester; lactone; 1fragment

相关文献及参考

  • Short: III/35E Title: Nuclear Magnetic Resonance (NMR) Data: Chemical Shifts for Oxygen-17 Author: Duddeck, H.; Toth, G.; Simon, A. Editor: Gupta, R.R.; Lechner, M.D. Source: Landolt-Börnstein, New Series Volume: III/35E Year: 2002 Keyword: Alipathic and Aromatic hydrocarbons; Coupling constant j; Nuclear Magnetic Resonance; chemical shifts δ ISBN: 3-540-42501-2 ISBN: 978-3-540-42501-4 Internet Resource: DOI:10.1007/b92953 RefComment: VII, 230 pages. With CD-ROM., Hardcover Abstract: This volume provides a comprehensive and evaluated compilation of nuclear magnetic resonance data. Chemical shifts and coupling constants of boron-11 and phosphorus-31 (subvol. A), fluorine-19 and nitrogen-15 (subvol. B), hydrogen-1 (subvol. C), carbon-13 (subvol. D), and oxygen-17 (subvol. E) compounds are tabulated together with the gross- and structure formulas and the most readily available solvents. Due to the large amount of the data merely chemical shifts are presented in the printed versions, and all the data, chemical shifts and coupling constants are provided on CD-ROM's.
  • Short: EINECS Title: EINECS (European Inventory of Existing Commercial Chemical Substances) Source: Official Journal of the European Communities Volume: C 146 A (15.06.1990) Page: 1 Year: 1990 Internet Resource: http://ecb.jrc.ec.europa.eu/esis/index.php?PGM=ein Publish_Date: 1990/06/15

安全信息

GHS Symbol
WGK Germany2
Precautionary statements
  • 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。
  • 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
  • P264 Wash hands thoroughly after handling. 处理后要彻底洗净双手。
  • P332+P313
  • P342+P311
  • P261 Avoid breathing dust/fume/gas/mist/vapours/spray. 避免吸入粉尘/烟/气体/烟雾/蒸汽/喷雾。
  • P305+P351+P338
  • P305+P351+P338+P337+P313
  • P302+P350
  • P337+P313
  • P302+P352+P332+P313+P362+P364
Hazard statements
  • H315 Causes skin irritation 会刺激皮肤
  • H319 Causes serious eye irritation 严重刺激眼睛
  • H334 May cause allergy or asthma symptoms or breathing difficulties if inhaled 吸入可能导致过敏或哮喘症状或呼吸困难
  • H335 May cause respiratory irritation 可能导致呼吸道刺激
RTECSGN6650000
Signal word Danger
Personal Protective Equipment dust mask type N95 (US), Eyeshields, Faceshields, Gloves
Safety Statements
  • S22 Do not breathe dust 不要吸入粉尘；
  • S36/37/39 Wear suitable protective clothing, gloves and eye/face protection 穿戴适当的防护服、手套和眼睛/面保护；
Risk Statements
  • R20/21/22 Harmful by inhalation, in contact with skin and if swallowed 吸入、皮肤接触和不慎吞咽有害
TYPE OF TEST            : LD50 - Lethal dose, 50 percent kill
ROUTE OF EXPOSURE       : Oral
SPECIES OBSERVED        : Rodent - mouse
DOSE/DURATION           : 3890 mg/kg
TOXIC EFFECTS :
   Behavioral - somnolence (general depressed activity)
   Behavioral - convulsions or effect on seizure threshold
   Behavioral - ataxia
REFERENCE :
   ESKHA5 Eisei Shikenjo Hokoku.  Bulletin of the Institute of Hygienic
   Sciences.  (Kokuritsu Eisei Shikenjo Kagaku, 18-1 Bushitsu Johobu,
   Setagaya-ku, Tokyo 158, Japan)  V.1-    1886-  Volume(issue)/page/year:
   (104),45,1986

TYPE OF TEST            : LDLo - Lowest published lethal dose
ROUTE OF EXPOSURE       : Oral
SPECIES OBSERVED        : Rodent - rat
DOSE/DURATION           : 1500 mg/kg
TOXIC EFFECTS :
   Details of toxic effects not reported other than lethal dose value
REFERENCE :
   CNREA8 Cancer Research. (Public Ledger Building, Suit 816, 6th & Chestnut
   Sts., Philadelphia, PA 19106)  V.1-    1941-  Volume(issue)/page/year:
   26,619,1966

Storage condition

其他信息

  • 7-二甲氨基-4-甲基香豆素价格(试剂级):更新日期 产品编号 产品名称 包装 价格 2014/06/02 D3355 7-(二甲基氨基)-4-甲基香豆素 7-(Dimethylamino)-4-methylcoumarin 5G 1210元 2014/06/02 D3355 7-(二甲基氨基)-4-甲基香豆素 7-(Dimethylamino)-4-methylcoumarin 25G 3710元
  • 下游产品:二氯喹啉酸
  • MOL 文件:87-01-4.mol
  • 上游原料:硝酸 --> 甘油 --> 3-氯-2-甲基苯胺
  • TCI Shanghai:7-二甲基氨基-4-甲基香豆素 7-(Dimethylamino)-4-methylcoumarin,>;95.0%(GC)(T)(87-01-4)
  • Sigma Aldrich:87-01-4(sigmaaldrich)

系列性分类

  1. Chemical Synthesis 化学合成
  2. Building Blocks 合成砌块
  3. Heterocyclic Building Blocks 杂环合成砌块
  4. Pyrans 派兰斯

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