2-Chlorothiazole-5-carbaldehyde 2-氯噻唑-5-甲醛

CAS 95453-58-0 MFCD01568717

化学结构图

95453-58-0
SMILES: O=CC1=CN=C(Cl)S1

化学属性

Mol. FormulaC4H2ClNOS
Mol. Weight148
Melting Point85-88°
TSCANo
Density
Boiling Point

别名和识别编码

Chemical Name2-Chlorothiazole-5-carbaldehyde
CAS Number95453-58-0
Alfabeta NameCHLOROTHIAZOLECARBALDEHYDE 2135-----,
MDL NumberMFCD01568717
Chemical Name Translation2-氯噻唑-5-甲醛
Synonym
EC Number
Beilstein Registry Number
PubChem Substance ID329790568
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分类

  • {KO} ReacChlorides
  • {KO} Aldehydes
  • {SNA} Building Blocks, C3 to C7, Chemical Synthesis, Heterocyclic Building Blocks, Thiazoles

安全信息

Warnings IRRITANT, KEEP COLD, STORED UNDER ARGON
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 Wear suitable protective clothing and gloves 穿戴适当的防护服和手套；
  • S37 Wear suitable gloves 戴适当手套；
  • S60 This material and its container must be disposed of as hazardous waste 该物质及其容器必须作为危险废物处置；
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
  • R43 May cause sensitisation by skin contact 皮肤接触会产生过敏反应
Storage condition Air Sensitive
GHS Symbol
WGK Germany3
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。
Signal word Warning
UN Number
Hazard Codes
RTECS
Packing Group
Hazard statements
  • H317 May cause an allergic skin reaction 可能导致皮肤过敏
  • H302 Harmful if swallowed 吞食有害

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
2
Rotatable Bonds
1
H-bond Donors
0
LogP
1

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. Thiazoles 噻唑
  5. C3 to C7 - Thiazoles

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