2-Amino-Oxazole 2-氨基恶唑

CAS 4570-45-0 MFCD07364485

化学结构图

4570-45-0
SMILES: Nc1ncco1

化学属性

Mol. FormulaC3H4N2O
Mol. Weight84.08
Melting Point90-95°C
TSCANo
Boiling Point186.6°C at 760 mmHg

别名和识别编码

Chemical Name2-Amino-Oxazole
CAS Number4570-45-0
Alfabeta NameOXAZOLAMINE 132---,
MDL NumberMFCD07364485
Synonym Oxazol-2-amine {LY} Oxazol-2-amine {} {LY} Oxazol-2-amine {} {} {LY} Oxazol-2-amine {} {} {} {LY} Oxazol-2-amine {} {} {} {} {LY} Oxazol-2-amine {} {} {} {} {} {LY} Oxazol-2-amine {} {} {} {} {} {} {LY} Oxazol-2-amine {} {} {} {} {} {} {} {LY} Oxazol-2-amine {} {} {} {} {} {} {} {} {LY} Oxazol-2-amine {} {} {} {} {} {} {} {} {} {LY} Oxazol-2-amine {} {} {} {} {} {} {} {} {} {} {LY} Oxazol-2-amine {} {} {} {} {} {} {} {} {} {} {} {LY} Oxazol-2-amine {} {} {} {} {} {} {} {} {} {} {} {} {LY} Oxazol-2-amine {} {} {} {} {} {} {} {} {} {} {} {} {} {LY} Oxazol-2-amine {} {} {} {} {} {} {} {} {} {} {} {} {} {} {LY} Oxazol-2-amine {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {LY} Oxazol-2-amine {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {LY} Oxazol-2-amine {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {LY} Oxazol-2-amine {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {LY} Oxazol-2-amine {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {LY} Oxa
Chemical Name Translation2-氨基恶唑
Reaxys-RN105736
PubChem Substance ID558521
LabNetwork Molecule IDLN00002481
InChIInChI=1S/C3H4N2O/c4-3-5-1-2-6-3/h1-2H,(H2,4,5)
Canonical SMILESNC1=NC=CO1
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分类

  • {SNA} Building Blocks, Chemical Synthesis, Heterocyclic Building Blocks, Oxazoles
  • {KO} AminesPrimary

安全信息

Warnings IRRITANT
Safety Statements
  • S24/25 Avoid contact with skin and eyes 避免皮肤和眼睛接触;
Hazard Codes Xi
GHS Symbol
WGK Germany3
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。
  • P305+P351+P338+P337+P313
  • P332+P313
  • 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
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
Risk Statements
  • R34 Causes burns 会导致灼伤
  • R36/37/38 Irritating to eyes, respiratory system and skin 对眼睛、呼吸系统和皮肤有刺激性
Storage condition 2-8°C, protect from light {LY} 2-8°C, protect from light {} {LY} 2-8°C, protect from light {} {} {LY} 2-8°C, protect from light {} {} {} {LY} 2-8°C, protect from light {} {} {} {} {LY} 2-8°C, protect from light {} {} {} {} {} {LY} 2-8°C, protect from light {} {} {} {} {} {} {LY} 2-8°C, protect from light {} {} {} {} {} {} {} {LY} 2-8°C, protect from light {} {} {} {} {} {} {} {} {LY} 2-8°C, protect from light {} {} {} {} {} {} {} {} {} {LY} 2-8°C, protect from light {} {} {} {} {} {} {} {} {} {} {LY} 2-8°C, protect from light {} {} {} {} {} {} {} {} {} {} {} {LY} 2-8°C, protect from light {} {} {} {} {} {} {} {} {} {} {} {} {LY} 2-8°C, protect from light {} {} {} {} {} {} {} {} {} {} {} {} {} {LY} 2-8°C, protect from light {} {} {} {} {} {} {} {} {} {} {} {} {} {} {LY} 2-8°C, protect from light {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {LY} 2-8°C, protect from light {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {}
UN Number 2735

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
0
H-bond Donors
1
LogP
5.211000000000000e-001

其他信息

  • 上游原料:氢氧化钠 --> 乙酸乙酯 --> 乙醚 --> 四氢呋喃 --> 石油醚 --> 硫酸钠 --> 氰胺 --> 羥乙醛
  • 下游产品:5-碘-2'-脱氧尿苷
  • Hazard Note:Irritant
  • MOL 文件:4570-45-0.mol

系列性分类


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