3-Azetidinecarboxylic Acid 吖丁啶-3-甲酸

CAS 36476-78-5 MFCD00191763

化学结构图

36476-78-5
SMILES: OC(=O)C1CNC1

化学属性

Mol. FormulaC4H7NO2
Mol. Weight101
Melting Point286
TSCANo
Density1.275
pH:A

别名和识别编码

Chemical Name3-Azetidinecarboxylic Acid
CAS Number36476-78-5
Alfabeta NameAZETANECARBOXYLICACID 3-
MDL NumberMFCD00191763
Synonym 3-吖丁啶羧酸 3-Carboxyazetidine CHA-811 3-羧基环丁胺 3-吖丁啶羧酸,氮杂环丁烷-3-羧酸
PubChem Substance ID24864361
Reaxys-RN385928
Beilstein Registry Number385928
EC Number250-023-7
Chemical Name Translation吖丁啶-3-甲酸
LabNetwork Molecule IDLN00009164
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分类

  • {SNA} Alicyclic Amino Acids, Chemical Biology, Chemical Synthesis, Peptide Chemistry, Unnatural Amino Acids & Derivatives
  • {SNA} Alicyclic Amino Acids, Chemical Biology, Chemical Synthesis, Peptide Chemistry, Unnatural Amino Acid Derivatives
  • Amino Acids & Derivatives
  • {KO} beta-Amino Acids
  • {KO} CarboxylicAcids
  • {KO} AminesSecondaryHeteroNH

产品应用

  • A useful intermediate in the synthesis of polypeptides.

相关文献及参考

  • Beilstein:22(5)1,23
  • 2. Weed Sci. 38 , 315, (1990)

安全信息

Warnings IRRITANT
WGK Germany3
RTECSCM4310600
Signal word Warning
GHS Symbol
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；
  • S36/37/39 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
  • 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 
TYPE OF TEST            : LD50 - Lethal dose, 50 percent kill
ROUTE OF EXPOSURE       : Administration onto the skin
SPECIES OBSERVED        : Rodent - rabbit
DOSE/DURATION           : >1 gm/kg
TOXIC EFFECTS :
   Details of toxic effects not reported other than lethal dose value
REFERENCE :
   FMCHA2 Farm Chemicals Handbook.  (Meister Pub., 37841 Euclid Ave.,
   Willoughy, OH 44094)  Volume(issue)/page/year: -,C65,1991

TYPE OF TEST            : LD50 - Lethal dose, 50 percent kill
ROUTE OF EXPOSURE       : Oral
SPECIES OBSERVED        : Rodent - rat
DOSE/DURATION           : >5 gm/kg
TOXIC EFFECTS :
   Details of toxic effects not reported other than lethal dose value
REFERENCE :
   FMCHA2 Farm Chemicals Handbook.  (Meister Pub., 37841 Euclid Ave.,
   Willoughy, OH 44094)  Volume(issue)/page/year: -,C65,1991

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 Donors
2
H-bond Acceptors
3
Rotatable Bonds
1
LogP
-6.562000000000000e-001

系列性分类

  1. Chemical Synthesis 化学合成
  2. Building Blocks 合成砌块
  3. Organic Building Blocks 有机砌块
  4. Nitrogen Compounds 氮化合物
  5. Imines/Amidines - Nitrogen Compounds
  1. Analytical & Chromatography 分析化学与色谱
  2. Analytical Standards
  3. Alphabetic - Analytical Standards
  4. B - Alphabetic
  5. BA - BH - B
  1. Chemical Synthesis 化学合成
  2. Chemical Biology 生物化学
  3. Peptide Chemistry 多肽化学
  4. Unnatural Amino Acid Derivatives 人工合成氨基酸
  5. Alicyclic Amino Acids 脂肪环氨基酸
  1. Chemical Synthesis 化学合成
  2. Chemical Biology 生物化学
  3. Peptide Chemistry 多肽化学
  4. Unnatural Amino Acid Derivatives 人工合成氨基酸
  5. Alicyclic Amino Acids 脂肪环氨基酸
  1. Chemical Synthesis 化学合成
  2. Building Blocks 合成砌块
  3. Chemicals by Class 化学分类法
  4. Simple 4-Membered Ring Compounds

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