1-(3-Dimethylaminopropyl)-3-ethylcarbodiimide (hydrochloride) 1-乙基-3-(3-二甲基氨基丙基)碳酰二亚胺盐酸盐

CAS 25952-53-8 MFCD00012503

化学结构图

25952-53-8
SMILES: CCN=C=NCCCN(C)C.Cl

化学属性

Mol. FormulaC8H18ClN3
Mol. Weight191.70
Melting Point110-115°C
TSCAT
Density0.877
Refractive index1.461
Stability易吸潮
Boiling Point197.7°C at 760 mmHg
pH:A

别名和识别编码

Chemical Name1-(3-Dimethylaminopropyl)-3-ethylcarbodiimide (hydrochloride)
CAS Number25952-53-8
Alfabeta NameETHYLIMINOMETHYLENEDIMETHYLPROPANEDIAMINEHYDROCHLORIDE NNN13313(())-----,,
MDL NumberMFCD00012503
Synonym 1-(3-Dimethylaminopropyl)-3-ethylcarbodiimide (hydrochloride) {LY} 1-(3-Dimethylaminopropyl)-3-ethylcarbodiimide (hydrochloride) {} {LY} 1-(3-Dimethylaminopropyl)-3-ethylcarbodiimide (hydrochloride) {} {} {LY} 1-(3-Dimethylaminopropyl)-3-ethylcarbodiimide (hydrochloride) {} {} {} {LY} 1-(3-Dimethylaminopropyl)-3-ethylcarbodiimide (hydrochloride) {} {} {} {} {LY} 1-(3-Dimethylaminopropyl)-3-ethylcarbodiimide (hydrochloride) {} {} {} {} {} {LY} 1-(3-Dimethylaminopropyl)-3-ethylcarbodiimide (hydrochloride) {} {} {} {} {} {} {LY} 1-(3-Dimethylaminopropyl)-3-ethylcarbodiimide (hydrochloride) {} {} {} {} {} {} {} {} {} {} {} {} {} {} {LY} 1-(3-Dimethylaminopropyl)-3-ethylcarbodiimide (hydrochloride) {} {} {} {} {} {} {} {} {LY} 1-(3-Dimethylaminopropyl)-3-ethylcarbodiimide (hydrochloride) {} {} {} {} {} {} {} {} {} {LY} 1-(3-Dimethylaminopropyl)-3-ethylcarbodiimide (hydrochloride) {} {} {} {} {} {} {} {} {} {} {LY} 1-(3-Dimethylaminopropyl)-3-ethylcarbodiimide (hydrochlori
PubChem Substance ID2723939
EC Number247-361-2
Beilstein Registry Number5764110
Chemical Name Translation1-乙基-3-(3-二甲基氨基丙基)碳酰二亚胺盐酸盐
Reaxys-RN5764110
InChIKeyFPQQSJJWHUJYPU-UHFFFAOYSA-N
LabNetwork Molecule IDLN00173825
InChIInChI=1S/C8H17N3.ClH/c1-4-9-8-10-6-5-7-11(2)3;/h4-7H2,1-3H3;1H
Canonical SMILESCN(C)CCCN=C=NCC.Cl
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分类

  • {SNA} Crosslinking, Heterobifunctional Cross-Linking Reagents, Protein Modification, Protein Structural Analysis, Proteomics
  • {SNA} Crosslinking, Heterobifunctional Cross-Linking Reagents, Protein Modification, 分子生物学, 蛋白质组学, 蛋白质结构分析
  • Crosslinking, Heterobifunctional Cross-Linking Reagents,

产品应用

  • 用于多肽缩合剂和交联剂,该品是水溶性碳二亚胺,主要用作多肽、蛋白质、核苷酸合成中的脱水剂,可实现快速多肽缩合反应的水溶性碳二亚胺型缩合剂。

相关文献及参考

  • For use in the acylation of phosphoranes, see (Cyanomethyl)­triphenyl­phosphonium chloride, A13096.
  • Drabick, J.J., et al., Covalent polymyxin B conjugate with human immunoglobulin G as an antiendotoxin reagent. Antimicrob. Agents Chemother. 42 , 583-588, (1998) 摘要
  • For use in the synthesis of cyclic derivatives of 3'-amino-3'-deoxyadenosine-5'-di- and triphosphates, see: Angew. Chem. Int. Ed., 33, 1394 (1994).
  • Dhaon, M.K., Synthesis of esters. J. Org. Chem. 47 , 1962, (1982)
  • Merck: 14,10328
  • Often used in conjunction with an additive such as HOBt (1-hydroxybenzotriazole hydrate) to suppress racemization; see, for example: Bull. Chem. Soc. Jpn., 55, 2165 (1982). A two-phase solvent system (dichloromethane-water or isopropyl acetate-water) has been found to give superior results in this type of peptide coupling: J. Org. Chem., 60, 3569 (1995). In a comparative study, submolar quantities HOBt in DMF-water gave good results: Chem. Lett., 1 (1997).
  • Thomas, J.O., et al., Altered arrangement of the DNA in injection-defective lambda bacteriophage. J. Mol. Biol. 123 , 149, (1978) 摘要
  • 'Water-soluble carbodiimide', widely used for peptide coupling (see Appendix 6), with the major advantage that excess reagent and the urea by-product can be easily removed by washing with dilute acid or water: J. Org. Chem., 26, 2525 (1961); J. Am. Chem. Soc., 87, 2492 (1965). For discussion of the mechanism of peptide coupling with this reagent, see: J. Am. Chem. Soc., 103, 7090 (1981).
  • Promotes various other N-acylation reactions such as the formation of N-acylsulfonamides from primary sulfonamides and N-protected amino acids in the presence of DMAP: Synlett,
  • Promotes various other N-acylation reactions such as the formation of N-acylsulfonamides from primary sulfonamides and N-protected amino acids in the presence of DMAP: Synlett, 1141 (1995).

安全信息

Warnings IRRITANT
GHS Symbol
WGK Germany3
Hazard Codes C Xi
Hazard statements
  • H302 Harmful if swallowed 吞食有害
  • H315 Causes skin irritation 会刺激皮肤
  • H318 Causes serious eye damage 严重伤害眼睛
  • H335 May cause respiratory irritation 可能导致呼吸道刺激
Personal Protective Equipment dust mask type N95 (US), Eyeshields, Gloves
RTECSFF2200000
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。
  • 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
  • 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
  • P332+P313
  • P302+P352+P332+P313+P362+P364
  • P301+P312+P330
  • 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。
  • P302+P350
  • P337+P313
  • P305+P351+P338+P337+P313
Signal word Danger Warning
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;
  • S36/37/39 Wear suitable protective clothing, gloves and eye/face protection 穿戴适当的防护服、手套和眼睛/面保护;
  • S45 In case of accident or if you feel unwell seek medical advice immediately (show the label where possible) 发生事故时或感觉不适时,立即求医(可能时出示标签);
  • 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;
  • S37 Wear suitable gloves 戴适当手套;
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
  • R37/38 Irritating to respiratory system and skin 对呼吸系统和皮肤有刺激性
  • R41 Risk of serious damage to eyes 有严重损伤眼睛的危险
  • R34 Causes burns 会导致灼伤
Storage condition 2-8°C, sealed storage, away from moisture {LY} 2-8°C, sealed storage, away from moisture 2-8℃密闭保存。 Moisture Sensitive {} {LY} 2-8°C, sealed storage, away from moisture {} {} {LY} 2-8°C, sealed storage, away from moisture {} {} {} {LY} 2-8°C, sealed storage, away from moisture {} {} {} {} {LY} 2-8°C, sealed storage, away from moisture {} {} {} {} {} {LY} 2-8°C, sealed storage, away from moisture {} {} {} {} {} {} {LY} 2-8°C, sealed storage, away from moisture {} {} {} {} {} {} {} {LY} 2-8°C, sealed storage, away from moisture {} {} {} {} {} {} {} {} {LY} 2-8°C, sealed storage, away from moisture {} {} {} {} {} {} {} {} {} {LY} 2-8°C, sealed storage, away from moisture {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {LY} 2-8°C, sealed storage, away from moisture {} {} {} {} {} {} {} {} {} {} {} {LY} 2-8°C, sealed storage, away from moisture {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {LY} 2-8°C, sealed storage, a
UN Number 2735

其他信息

  • F:3-10-21
  • MOL 文件:7084-11-9.mol
  • 极易吸潮。水中溶解度:>20g/100ml 溶于乙醇。

系列性分类