2-Amino-4,6-dichloropyrimidine-5-carbaldehyde 2-氨基-4,6-二氯嘧啶-5-甲醛

CAS 5604-46-6 MFCD03001242

化学结构图

5604-46-6
SMILES: Nc1nc(Cl)c(C=O)c(Cl)n1

化学属性

Mol. FormulaC5H3Cl2N3O
Mol. Weight192.00
Melting Point208-224°C
TSCANo
Stability对空气敏感
Boiling Point411.6°C at 760 mmHg

别名和识别编码

Chemical Name5-​Pyrimidinecarboxalde​hyde, 2-​amino-​4,​6-​dichloro-
CAS Number5604-46-6
Alfabeta NameAMINODICHLOROPYRIMIDINECARBALDEHYDE 2465-----,
MDL NumberMFCD03001242
PubChem Substance ID265546
Synonym 2-Amino-4,6-dichloropyrimidine-5-carbaldehyde {LY} 2-Amino-4,6-dichloropyrimidine-5-carbaldehyde {} {LY} 2-Amino-4,6-dichloropyrimidine-5-carbaldehyde {} {} {LY} 2-Amino-4,6-dichloropyrimidine-5-carbaldehyde {} {} {} {LY} 2-Amino-4,6-dichloropyrimidine-5-carbaldehyde {} {} {} {} {LY} 2-Amino-4,6-dichloropyrimidine-5-carbaldehyde {} {} {} {} {} {LY} 2-Amino-4,6-dichloropyrimidine-5-carbaldehyde {} {} {} {} {} {} {LY} 2-Amino-4,6-dichloropyrimidine-5-carbaldehyde {} {} {} {} {} {} {} {} {} {} {} {} {} {} {LY} 2-Amino-4,6-dichloropyrimidine-5-carbaldehyde {} {} {} {} {} {} {} {} {LY} 2-Amino-4,6-dichloropyrimidine-5-carbaldehyde {} {} {} {} {} {} {} {} {} {LY} 2-Amino-4,6-dichloropyrimidine-5-carbaldehyde {} {} {} {} {} {} {} {} {} {} {LY} 2-Amino-4,6-dichloropyrimidine-5-carbaldehyde {} {} {} {} {} {} {} {} {} {} {} {LY} 2-Amino-4,6-dichloropyrimidine-5-carbaldehyde {} {} {} {} {} {} {} {} {} {} {} {} {LY} 2-Amino-4,6-dichloropyrimidine-5-carbaldehyde {} {} {} {} {}
Chemical Name Translation2-氨基-4,6-二氯嘧啶-5-甲醛
LabNetwork Molecule IDLN00145634
InChIInChI=1S/C5H3Cl2N3O/c6-3-2(1-11)4(7)10-5(8)9-3/h1H,(H2,8,9,10)
Canonical SMILESO=CC1=C(Cl)N=C(N)N=C1Cl
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分类

  • {KO} ReacChlorides
  • Aldehydes, Building Blocks, C1 to C6, C4 to C5, Carbonyl Compounds, Chemical Synthesis, Halogenated Heterocycles, Heterocyclic Building Blocks, Organic Building Blocks, Pyrimidines
  • {KO} Aldehydes
  • {KO} AminesPrimary
  • {SNA} Aldehydes, Building Blocks, C1 to C6,

相关文献及参考

  • 1. Synthesis , 3159, (2005)

安全信息

Warnings IRRITANT, KEEP COLD
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。
  • P264 Wash hands thoroughly after handling. 处理后要彻底洗净双手。
  • P264+P265
  • P270 Do not eat, drink or smoke when using this product. 使用本产品时不要吃东西，喝水或吸烟。
  • P271 Use only outdoors or in a well-ventilated area.? 只能在室外或通风良好的地方使用。
  • P272 Contaminated work clothing should not be allowed out of the workplace. 污染的工作服不得带出工作场所。
  • 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。
  • P301+P312
  • P301+P317
  • P302+P352
  • P304+P340
  • P305+P351+P338
  • P312 Call a POISON CENTER or doctor/physician if you feel unwell. 如果你感觉不适，呼叫解毒中心或医生/医师。
  • P319
  • P321 Specific treatment (see … on this label). 具体治疗（见本标签上的）。
  • P330 Rinse mouth. 漱口
  • P332+P313
  • P332+P317
  • P333+P313
  • P333+P317
  • P337+P313
  • P337+P317
  • 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
  • P362+P364
  • P363 Wash contaminated clothing before reuse. 被污染的衣服洗净后方可重新使用。
  • P403+P233
  • P405 Store locked up. 上锁保管。
  • P501 Dispose of contents/container to..… 处理内容物/容器.....
Signal word Warning
Hazard statements
  • H302 Harmful if swallowed 吞食有害
  • H315 Causes skin irritation 会刺激皮肤
  • H317 May cause an allergic skin reaction 可能导致皮肤过敏
  • 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 Xn Xn,Xi
Personal Protective Equipment dust mask type N95 (US), Eyeshields, Faceshields, Gloves
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；
Risk Statements
  • R22 Harmful if swallowed 吞咽有害
  • 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 -20°C, protect from light, stored under nitrogen {LY} -20°C, protect from light, stored under nitrogen Air Sensitive {} {LY} -20°C, protect from light, stored under nitrogen {} {} {LY} -20°C, protect from light, stored under nitrogen {} {} {} {LY} -20°C, protect from light, stored under nitrogen {} {} {} {} {LY} -20°C, protect from light, stored under nitrogen {} {} {} {} {} {LY} -20°C, protect from light, stored under nitrogen {} {} {} {} {} {} {LY} -20°C, protect from light, stored under nitrogen {} {} {} {} {} {} {} {LY} -20°C, protect from light, stored under nitrogen {} {} {} {} {} {} {} {} {LY} -20°C, protect from light, stored under nitrogen {} {} {} {} {} {} {} {} {} {LY} -20°C, protect from light, stored under nitrogen {} {} {} {} {} {} {} {} {} {} {LY} -20°C, protect from light, stored under nitrogen {} {} {} {} {} {} {} {} {} {} {} {LY} -20°C, protect from light, stored under nitrogen {} {} {} {} {} {} {} {} {} {} {} {} {LY} -20°C, protect from li

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
1
LogP
1

其他信息

  • 敏感性:Air Sensitive
  • Alfa Aesar:2-氨基-4,6-二氯嘧啶-5-甲醛,97% 2-Amino-4,6-dichloropyrimidine-5-carboxaldehyde, 96%(5604-46-6)
  • Sigma Aldrich:5604-46-6(sigmaaldrich)
  • MOL 文件:5604-46-6.mol
  • 2-氨基-4,6-二氯嘧啶-5-甲醛价格(试剂级):更新日期 产品编号 产品名称 包装 价格 2010/05/25 H27844 2-氨基-4,6-二氯嘧啶-5-甲醛,97% 2-Amino-4,6-dichloropyrimidine-5-carboxaldehyde, 96% 1g 1086元

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. Halogenated Heterocycles 卤代杂环
  5. Pyrimidines - Halogenated Heterocycles
  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. Halogenated Heterocycles 卤代杂环
  5. Pyrimidines - Halogenated Heterocycles
  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. Pyrimidines 嘧啶
  5. C4 to C5 - Pyrimidines

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