(S)-1,4-Benzodioxane-2-Carboxylic Acid (s)-1,4-苯并二噁烷-2-甲酸

CAS 70918-54-6 MFCD00239408

化学结构图

70918-54-6
SMILES: OC(=O)[C@@H]1COC2=CC=CC=C2O1 |&1:3|

化学属性

Mol. FormulaC9H8O4
Mol. Weight180.16
Melting Point96-99 °C

别名和识别编码

Chemical Name(S)-1,4-Benzodioxane-2-Carboxylic Acid
Synonym DL-Phenylalanine, N-acetyl- N-acetyl-3-phenyl-DL-alanine (S)-2,3-二氢-1,4-苯并二噁英-2-羧酸 (S)-1,4-苯并二噁烷-2-羧酸 DL-2-(Acetylamino)-3-phenylpropanoic acid
MDL NumberMFCD00239408
PubChem Substance ID57646994
Beilstein Registry Number5742836
CAS Number70918-54-6
EC Number220-793-9
InChIKeyCBQJSKKFNMDLON-UHFFFAOYSA-N
Chemical Name Translation(s)-1,4-苯并二噁烷-2-甲酸
LabNetwork Molecule IDLN00227063
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分类

  • {uni_hamburg} no charge; carbocycle; aromatic; 6RingOnly; 6ring; carboxylic acid; amide; racemate; 1fragment
  • {SA} Asymmetric Synthesis, Benzodioxanes, Chemical Synthesis, Chiral Building Blocks, Chiral Resolution Reagents, Chiral Resolving Reagents, Heterocyclic Building Blocks
  • Asymmetric Synthesis, Benzodioxanes, Chemical Synthesis, Chiral Building Blocks, Chira

相关文献及参考

  • 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
  • Short: III/20a Title: Nuclear Quadrupole Resonance Spectroscopy Data: Nuclei D ... Cl Author: Chihara, H.; Nakamura, N. Editor: Hellwege, K.-H.; Hellwege, A.M. Source: Landolt-Börnstein, New Series Volume: III/20a Year: 1988 Keyword: NQR ISBN: 3-540-18161-X ISBN: 978-3-540-18161-3 Internet Resource: DOI:10.1007/b31153 RefComment: IX,677 pages. Hardcover Abstract: Nuclear Quadrupole Resonance Spectroscopy has become a standard method for structural research in molecular and solid state physics as well as for different branches of chemistry. The volumes cover data for more than 8,000 substances in the solid state. Data for free molecules have been published in volumes II/14 and II/15 of the New Series. The tables are arranged according to the atomic number of the elements.

安全信息

WGK Germany3
GHS Symbol
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。
  • P305+P351+P338
Hazard statements
  • 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
Hazard Codes Xi
Personal Protective Equipment dust mask type N95 (US), Eyeshields, Gloves
Signal word Warning
Safety Statements
  • 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 Wear suitable protective clothing 穿戴适当的防护服；
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

系列性分类

  1. Chemical Synthesis 化学合成
  2. Asymmetric Synthesis 不对称合成
  3. Chiral Resolution Reagents - Asymmetric Synthesis
  4. Chiral Resolving Reagents - Chiral Resolution Reagents
  1. Chemical Synthesis 化学合成
  2. Asymmetric Synthesis 不对称合成
  3. Chiral Building Blocks 手性分子砌块
  4. Heterocyclic Building Blocks - Chiral Building Blocks
  5. Benzodioxanes - Heterocyclic Building Blocks

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