6-Methyl-4-Oxo-4H-Chromene-3-Carbaldehyde 6-甲基-4-氧代-4H-苯并吡喃-3-甲醛

CAS 42059-81-4 MFCD00138943

化学结构图

42059-81-4
SMILES: CC1C=CC2OC=C(C=O)C(=O)C=2C=1

化学属性

Mol. FormulaC11H8O3
Mol. Weight188
Melting Point172-173
Density1.422

别名和识别编码

Chemical Name6-Methyl-4-Oxo-4H-Chromene-3-Carbaldehyde
CAS Number42059-81-4
Alfabeta NameMETHYLOXOCHROMENECARBALDEHYDE H6443-------
MDL NumberMFCD00138943
Synonym 3-甲酰基-6-甲基色酮 6-Methyl-4-oxo-4H-1-benzopyran-3-carboxaldehyde
PubChem Substance ID253661463
EC Number250-023-7
Beilstein Registry Number2384789
Chemical Name Translation6-甲基-4-氧代-4H-苯并吡喃-3-甲醛
Reaxys-RN1073905
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分类

  • {KO} Ketones
  • {SNA} Aldehydes, Benzopyrans, Building Blocks, C10-C12, Carbonyl Compounds, Chemical Synthesis, Heterocyclic Building Blocks, Organic Building Blocks
  • {KO} Aldehydes
  • Aldehydes, Benzopyrans, Building Blocks, C10-C12, Carbonyl Compounds, Chemical Synthesis, Heterocyclic Building Blocks, Organic Building Blocks
  • {KO} Dicarbonyls13

相关文献及参考

  • FT-IR 2 (2), 2567:B

安全信息

Warnings IRRITANT
WGK Germany3
Personal Protective Equipment Eyeshields, Gloves, type N95 (US), type P1 (EN143) respirator filter
Signal word Warning
GHS Symbol
Safety Statements
  • S24/25 Avoid contact with skin and eyes 避免皮肤和眼睛接触；
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
Precautionary statements
  • 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。
  • 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+P332+P313+P362+P364
  • P305+P351+P338+P337+P313
Hazard statements
  • H315 Causes skin irritation 会刺激皮肤

药物吸收、分布、代谢与排泄(ADME)

Lipinski's Rule of 3
Y
Lipinski's Rule of 5
Y
H-bond Acceptors
3
Rotatable Bonds
1
H-bond Donors
0
LogP
1

系列性分类

  1. Analytical & Chromatography 分析化学与色谱
  2. Analytical Reagents
  3. Application Specific Reagents - Analytical Reagents
  4. Test Papers/Sticks - Application Specific Reagents
  5. pH Papers/Sticks - Test Papers/Sticks
  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. Benzopyrans 苯并吡喃
  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. Ketones - Carbonyl Compounds
  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. C10-C12 - Aldehydes

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