2-Amino-5,6-dimethyl-1H-pyrimidin-4-one 2-氨基-5,6-二甲基嘧啶-4(3H)-酮

CAS 3977-23-9 MFCD00023258

化学结构图

3977-23-9
SMILES: Cc1nc(N)[nH]c(=O)c1C

化学属性

Mol. FormulaC6
Mol. Weight139
Melting Point333-337 °C (lit.)
TSCANo
Boiling Point341°C

别名和识别编码

Chemical Name2-Amino-5,6-dimethyl-1H-pyrimidin-4-one
CAS Number3977-23-9
Alfabeta NameAMINODIMETHYLPYRIMIDINOL 2564-----,
MDL NumberMFCD00023258
EC Number223-611-6
PubChem Substance ID135402388
Synonym 2-氨基-5,6-二甲基-4-羟基嘧啶 4(1H)-Pyrimidinone, 2-amino-5,6-dimethyl- (9CI) 2-AMINO-5,6-DIMETHYL-4-HYDROXYPYRIMIDINE 2-AMINO-5,6-DIMETHYL-4-PYRIMIDINOL 5，6-二甲基-2-氨基-4-羟基嘧啶 2-AMINO-5,6-DIMETHYLPYRIMIDIN-4-OL 2-Amino-5,6-dimethylpyrimidin-4(1H)-one 2-amino-5,6-dimethyl-1H-pyrimidin-4-one 2-Amino-5,6-dimethyl-4-hydroxypyrimidine BUTTPARK 11\02-61
Chemical Name Translation2-氨基-5,6-二甲基嘧啶-4(3H)-酮
LabNetwork Molecule IDLN00147840
InChIInChI=1S/C6H9N3O/c1-3-4(2)8-6(7)9-5(3)10/h1-2H3,(H3,7,8,9,10)
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分类

  • {KO} HeteroArylOH
  • {KO} AminesPrimary
  • {SNA} Building Blocks, C6 to C8, Chemical Synthesis, Heterocyclic Building Blocks, Pyrimidines

安全信息

Warnings IRRITANT
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；
  • 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；
  • 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
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
  • 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。
  • 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
  • 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）。
  • P332+P313
  • P332+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
  • P403+P233
  • P405 Store locked up. 上锁保管。
  • P501 Dispose of contents/container to..… 处理内容物/容器.....
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
Signal word Warning
Personal Protective Equipment dust mask type N95 (US), Eyeshields, Gloves
Hazard Codes Xi

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
0
LogP
1

其他信息

  • Alfa Aesar:2-氨基-5,6-二甲基-4-羟基嘧啶,97% 2-Amino-5,6-dimethyl-4-hydroxypyrimidine, 97%(3977-23-9)
  • Sigma Aldrich:3977-23-9(sigmaaldrich)
  • Hazard Note:Irritant
  • 上游原料:盐酸 --> 甲醇 --> 氨 --> 碳酸胍 --> 2-甲基乙酰乙酸乙酯
  • 5，6-二甲基-2-氨基-4-羟基嘧啶价格(试剂级):更新日期 产品编号 产品名称 包装 价格 2010/05/25 43432 2-氨基-5,6-二甲基-4-羟基嘧啶, 97% 2-Amino-5,6-dimethyl-4-hydroxypyrimidine, 97% 5g 2534元 2010/05/25 43432 2-氨基-5,6-二甲基-4-羟基嘧啶, 97% 2-Amino-5,6-dimethyl-4-hydroxypyrimidine, 97% 25g 10164元 2010/05/25 43432 2-氨基-5,6-二甲基-4-羟基嘧啶, 97% 2-Amino-5,6-dimethyl-4-hydroxypyrimidine, 97% 1g 648元
  • MOL 文件:3977-23-9.mol

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. Pyrimidines 嘧啶
  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. C6 to C8 - Pyrimidines

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