Basic information
- CAS
217817-03-3- Standard SMILES
CNCCOCCOCCOCCC(=O)OC(C)(C)C- InChIKey
AUPLFZLXXCVJFE-UHFFFAOYSA-N- Molecular formula
- C14H29NO5
- Average molar mass
- 291.38 g/mol
- Monoisotopic mass
- 291.20457303
Names & identifiers
- Preferred name
- Methylamino-PEG3-t-butyl ester
- IUPAC
- tert-butyl 3-[2-[2-[2-(methylamino)ethoxy]ethoxy]ethoxy]propanoate
- English name
- MeNH-PEG3-CH2CH2COOtBu
- Molecular formula
- C14H29NO5
- Molecular weight
- 291.38
Names & synonyms
Methylamino-PEG3-t-butyl ester217817-03-3tert-butyl 5,8,11-trioxa-2-azatetradecan-14-oateMeNH-PEG3-CH2CH2COOtBu1,1-Dimethylethyl 4,7,10-trioxa-13-azatetradecanoate4,7,10-Trioxa-13-azatetradecanoic acid, 1,1-dimethylethyl estertert-butyl 3-[2-[2-[2-(methylamino)ethoxy]ethoxy]ethoxy]propanoatetert-butyl 3-(2-(2-(2-(methylamino)ethoxy)ethoxy)ethoxy)propanoateSCHEMBL40011orb1984622AUPLFZLXXCVJFE-UHFFFAOYSA-NDTXSID901220292
Show more names
MeNH-PEG3-COOtBuMeNH-PEG3-CH2CH2COOtBu/4,7,10-Trioxa-13-azatetradecanoic acid, 1,1-dimethylethyl ester
AKOS040757394DA-55416HY-132071CS-0148291T39666tert-butyl 3-(2-(2-(2-methylaminoethoxy)ethoxy)ethoxy)propanoatetert-butyl 3-(2-(2-(2-(methylamino)ethoxy)ethoxy)ethoxy)-propanoate3-[2-[2-[2-(methylamino)ethoxy]ethoxy]ethanol]propanoic acid tert-butyl ester
Database identifiers
- CAS
217817-03-3- PubChem CID
- 53662991
- DTXSID
DTXSID901220292
Properties
Computed structural properties
- XLogP
- 0.2
- Topological polar surface area
- 66 Ų
- Hydrogen bond donors
- 1
- Hydrogen bond acceptors
- 6
- Rotatable bonds
- 14
- Heavy atoms
- 20
- Formal charge
- 0
- Complexity
- 240
Physicochemical properties
- Boiling point
- 360.2 · 360.2±27.0 °C(Predicted)
- Density
- 1.001 · 1.001±0.06 g/cm3(Predicted)
- pka
- 9.52 · 9.52±0.10(Predicted)
Chemistry & industry
Applications
UsesMethylamino-PEG3-t-butyl ester is a PEG-based PROTAC linker that can be used in the synthesis of PROTACs[1].
Suppliers11 total
吉林中科研伸科技有限公司18143011203 · [email protected]
Science Care Ningbo Co.,Ltd+86-574-87260203 +86-18368238604 · [email protected]
上海皓鸿生物医药科技有限公司400-8210725 4008210725 · [email protected]
上海研纷生化科技有限公司13611955358 15002190549 · [email protected]
Xian confluore Biological Technology Co., Ltd.+86-15680926068 · [email protected]
许昌峰飞新材料科技有限公司19713077352; 19713077352 · [email protected]
苏州爱玛特生物科技有限公司0512-56316828 400-867-5858;400-867-5858 · [email protected]
西安康福诺生物科技有限公司+86-156-80926068 +86-15680926068 · [email protected]
山东博宇生物技术有限公司13356310019 · [email protected]
Jilin Chinese Academy of Sciences-yanshen Technology18143011203 · [email protected]
河南梦泰医药科技有限公司17634413542 · [email protected]
Related reactions
15 records
Compound notes
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