Basic information
- CAS
24277-38-1- Standard SMILES
COC(=O)CC[C@H](NC(=O)OC(C)(C)C)C(=O)OC(C)(C)C- InChIKey
IURKEBKDWQGPJJ-JTQLQIEISA-N- Molecular formula
- C15H27NO6
- Average molar mass
- 317.38 g/mol
Names & identifiers
- Preferred name
- (S)-1-tert-Butyl 5-methyl 2-((tert-butoxycarbonyl)amino)pentanedioate
- IUPAC
- 1-O-tert-butyl 5-O-methyl (2S)-2-[(2-methylpropan-2-yl)oxycarbonylamino]pentanedioate
- English name
- (S)-1-tert-Butyl 5-methyl 2-((tert-butoxycarbonyl)amino)pentanedioate
- Molecular formula
- C15H27NO6
- Molecular weight
- 317.38
Names & synonyms
24277-38-1(S)-1-tert-Butyl 5-methyl 2-((tert-butoxycarbonyl)amino)pentanedioate1-(tert-Butyl) 5-methyl (tert-butoxycarbonyl)-L-glutamate1-tert-butyl 5-methyl (2S)-2-{[(tert-butoxy)carbonyl]amino}pentanedioateMFCD275783321-O-tert-butyl 5-O-methyl (2S)-2-[(2-methylpropan-2-yl)oxycarbonylamino]pentanedioateIURKEBKDWQGPJJ-JTQLQIEISA-NN-[(1,1-Dimethylethoxy)carbonyl]-L-glutamic Acid 1-(1,1-Dimethylethyl) 5-Methyl Ester; N-Carboxy-L-glutamic Acid N,1-Di-t-butyl Methyl Ester;Boc-Glu(OMe)-OtBuN-Boc 1-O-t-Butyl 5-O-Methoxy L-Glutamic AcidSCHEMBL2390166AT19903
Show more names
Boc-Glu(OCH3)-OtBuVelpatasvir Impurity 291- (tert butyl) 5-methyl (tert butoxycarbonyl) L-glutamic acid1-(tert-Butyl) 5-methyl (tert-butoxycarbonyl)-L-glutamate - [B93931](S)-1-tert-butyl 5-methyl 2-((tert-butoxycarbonyl)amino)pentanedioate(WXG02484)
BS-27710SY334654CS-0129476F9879741-tert-Butyl 5-Methyl (S)-2-(Boc-amino)pentanedioate(S)-1-tert-Butyl 5-methyl 2-(tert-butoxycarbonylamino)pentanedioate(S)-1-tert-Butyl5-methyl2-((tert-butoxycarbonyl)amino)pentanedioateN-tert.-butyloxycarbonyl-L-glutamic acid 5-methyl ester 1-tert.-butyl ester
Properties
Computed structural properties
- XLogP
- 2
- Topological polar surface area
- 90.9 Ų
- Hydrogen bond donors
- 1
- Hydrogen bond acceptors
- 6
- Rotatable bonds
- 10
- Heavy atoms
- 22
- Formal charge
- 0
- Complexity
- 405
Physicochemical properties
- Melting point
- 65 · 65-67 °C(Solv: ethanol, 50% (64-17-5))
- Boiling point
- 403.1 · 403.1±35.0 °C(Predicted)
- Density
- 1.072 · 1.072±0.06 g/cm3(Predicted)
- storage temp.
- -20 °C · -20°C Freezer
- solubility
- Chloroform, DCM
- form
- Syrup
- pka
- 10.86 · 10.86±0.46(Predicted)
- color
- Colorless
- Symbol(GHS)
- 7 · GHS07
- Signal word
- Warning
- Hazard statements
- 302 · H302-H315-H319
- Precautionary statements
- 261 · P261-P301+P312-P302+P352-P304+P340-P305+P351+P338
Safety & regulation
Safety information is for reference only and does not replace the supplier’s Safety Data Sheet (SDS), applicable regulations, or professional assessment.
Safety data
- Signal word
- Warning
- Symbol(GHS)
- GHS07
- Hazard statements
- H302-H315-H319
- Precautionary statements
- P261-P301+P312-P302+P352-P304+P340-P305+P351+P338
Chemistry & industry
Applications
UsesN-Boc 1-O-t-Butyl 5-O-Methoxy L-Glutamic Acid is an intermediate used in the synthesis of Isodesmosine Chloride Hydrate (Synthetic) (I815051), which is a component of elastin and also it is extremely hygroscopic and must be stored over a desiccant such as silica gel.
Upstream & downstream products
Downstream products
Suppliers37 total
Career Henan Chemica Co+86-0371-86658258 +86-13203830695 · [email protected]
湖北威德利化学试剂有限公司186-02735115 18062128043 · [email protected]
上海炎泽化工有限公司15345144255 19975051755 · [email protected]
上海毕得医药科技股份有限公司400-1647117 13681763483 · [email protected]
Shanghai Yingrui Biopharma Co.,Ltd21-33585366 · [email protected]
湖南瑞威尔生物科技有限公司18627957289 18173226957 · [email protected]
上海鸿肽生物科技有限公司15318089928 · [email protected]
北京索莱宝科技有限公司010-50973130 17801761073 · [email protected]
安耐吉化学&3A（安徽泽升科技有限公司）021-58432009 400-005-6266 · [email protected]
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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