N-Boc-1,3-propanediamine N-叔丁氧羰基-1,3-丙二胺
CAS 75178-96-0 MFCD00210021
化学结构图
SMILES: CC(C)(C)OC(=O)NCCCN
化学属性
| Mol. Formula | C8H18N2O2 |
|---|---|
| Mol. Weight | 174 |
| Refractive index | n20/D 1.454(lit.) |
| Boiling Point | 203 |
| Density | 0.998 |
| Melting Point | 22 |
| TSCA | No |
| Solubility | 完全溶解于甲醇 |
| Stability | 对空气敏感 |
别名和识别编码
| Chemical Name | N-Boc-1,3-propanediamine |
|---|---|
| CAS Number | 75178-96-0 |
| Alfabeta Name | BUTYLAMINOPROPYLCARBAMATE TERTN3()--- |
| MDL Number | MFCD00210021 |
| Synonym | N-(3-氨基丙基)氨基甲酸叔丁酯 N-Boc-1,3-二氨基丙烷 N-Boc-1,3-propanediamine N-叔丁氧羰基-1,3-丙二胺 N-Boc-1,3-二氨基丙烷 N-(叔丁氧羰基)-1,3-二氨基丙烷 ,N-Boc-1,3-二氨基丙烷,N-(3-氨基丙基)氨基甲酸叔丁酯 ,N-Boc-1,3-丙二氨 |
| PubChem Substance ID | 87562827 |
| Beilstein Registry Number | 3588328 |
| EC Number | 250-023-7 |
| Reaxys-RN | 3588328 |
| Chemical Name Translation | N-叔丁氧羰基-1,3-丙二胺 |
| LabNetwork Molecule ID | LN00010217 |
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分类
- Bifunctional Linkers, Building Blocks, Chemical Biology, Chemical Synthesis, Linkers and Crosslinkers, Nitrogen Compounds, Organic Building Blocks, Protected Amines
- {SNA} Bifunctional Linkers, Building Blocks, Chemical Biology, Chemical Synthesis, Linkers and Crosslinkers, Nitrogen Compounds, Organic Building Blocks, Protected Amines
- {KO} tBocN
- {KO} AminesPrimary
产品应用
- 合成亚精胺类似物;制备药理活性化合物
相关文献及参考
- FT-IR 2 (1), 1303:B / Structure Index 1 , 139:A:8
安全信息
GHS Symbol
- H314 Causes severe skin burns and eye damage 导致严重的皮肤灼伤和眼睛损伤
- H302 Harmful if swallowed 吞食有害
- P303+P361+P353+P310+P363
- P264 Wash hands thoroughly after handling. 处理后要彻底洗净双手。
- P501 Dispose of contents/container to..… 处理内容物/容器.....
- P261 Avoid breathing dust/fume/gas/mist/vapours/spray. 避免吸入粉尘/烟/气体/烟雾/蒸汽/喷雾。
- P305+P351+P338
- 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+P330+P331
- P405 Store locked up. 上锁保管。
- P304+P340
- P310 Immediately call a POISON CENTER or doctor/physician. 立即呼救解毒中心或医生/医师。
- P260 Do not breathe dust/fume/gas/mist/vapours/spray. 不要吸入粉尘/烟/气体/烟雾/蒸汽/喷雾。
- P304+P340+P310
- R36/37/38 Irritating to eyes, respiratory system and skin 对眼睛、呼吸系统和皮肤有刺激性
药物吸收、分布、代谢与排泄(ADME)
Lipinski's Rule of 5
Y
H-bond Acceptors
3
Rotatable Bonds
5
H-bond Donors
2
LogP
-6.560000000000001e-002
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