Basic information
- CAS
16874-06-9- Standard SMILES
CC(C)(C)OC(=O)CCC(N)C(=O)OC(C)(C)C- InChIKey
NTUGPDFKMVHCCJ-UHFFFAOYSA-N- Molecular formula
- C13H25NO4
- Average molar mass
- 259.34 g/mol
- Monoisotopic mass
- 259.17835828
Overview
RN given refers to (L)-isomer; structure given in first source
Names & identifiers
- Preferred name
- Di-tert-butyl glutamate
- IUPAC
- ditert-butyl 2-aminopentanedioate
- English name
- L-Glutamic acid di-tert-butylester diben zenesulfimide salt
- Molecular formula
- C13H25NO4
- Molecular weight
- 259.34
Names & synonyms
Di-tert-butyl glutamateDTXSID70937536glutamic acid di-tert-butyl esterGTBERefChem:132518DTXCID60202528Bis(tert-butyl) L-glutamateditert-butyl 2-aminopentanedioate(R)-Di-tert-butyl 2-aminopentanedioateEINECS 240-900-2SCHEMBL1841835SCHEMBL28748044
Show more names
H-Glu(OtBu)-OtBuDi-tert-butyl L-glutaMatea,g-Di-tert-butyl L-gL-GlutaMic acid di-tert-butyl esterditert-butyl (2S)-2-aminopentanedioate(S)-Di-tert-butyl 2-aminopentanedioateGlutaMic acid, di-tert-butyl ester (6CI)
NTUGPDFKMVHCCJ-UHFFFAOYSA-Ndi-tert-butyl 2-aminopentanedioate767593-49-7
Database identifiers
- CAS
16874-06-9- PubChem CID
- 86076
- DTXSID
DTXSID70937536
Properties
Computed structural properties
- XLogP
- 1.4
- Topological polar surface area
- 78.6 Ų
- Hydrogen bond donors
- 1
- Hydrogen bond acceptors
- 5
- Rotatable bonds
- 8
- Heavy atoms
- 18
- Formal charge
- 0
- Complexity
- 299
Physicochemical properties
- Melting point
- 139 · 139-141 °C (dec.)
- Boiling point
- 311.1 · 311.1±27.0 °C(Predicted)
- Density
- 1.02 · 1.020±0.06 g/cm3(Predicted)
- pka
- 6.85 · 6.85±0.35(Predicted)
- Safety Statements
- 22 · 22-24/25
- WGK Germany
- 3 · 3
Safety & regulation
Safety data
- wgk
- 3
- safety_code
- 22-24/25
Chemistry & industry
Applications
UsesH-Glu(OtBu)-OtBu is a glutamic acid derivative[1].
Upstream & downstream products
Upstream raw materials
Suppliers25 total
湖北永阔科技有限公司027-59223108 15972152991 · [email protected]
江苏吉泰肽业科技有限公司051580855088 18762539991 · [email protected]
上海麦克林生化科技股份有限公司021-50706066 15221275939 · [email protected]
上海毕得医药科技股份有限公司400-1647117 13681763483 · [email protected]
Hangzhou Sage Chemical Co., Ltd.+86057186818502 13588463833 · [email protected]
烟台盛凯伦生物制品有限公司13356901049 · [email protected]
苏州爱玛特生物科技有限公司0512-56316828 4008675858 · [email protected]
深圳振强药物研发有限公司+86-0755-66853366 +86-13670046396 · [email protected]
斯派螺（武汉）药物研发有限公司[email protected]
上海阿拉丁生化科技股份有限公司6206333 13167063860 · [email protected]
上海源叶生物科技有限公司13636370518 · [email protected]
上海英奇曼化学科技有限公司18299177127 · [email protected]
深圳市创鑫生物科技有限公司13417589054 · [email protected]
烟台盛凯伦化学科技有限公司13356901049 · [email protected]
上海研纷生化科技有限公司17721070236 13611955358 · [email protected]
吉尔多肽生物制药（大连市）有限公司021-61263455 13167021076 · [email protected]
江苏艾康生物医药研发有限公司025-58859352 15955137747 · [email protected]
ATK CHEMICAL COMPANY LIMITED+undefined-21-51877795 · [email protected]
上海吉奉生物科技有限公司021-61263377 15023907684 · [email protected]
深圳市创鑫生物科技有限公司13417589054 · [email protected]
滨海吉尔多肽有限公司021-61263389 13524856427 · [email protected]
四川嘉瑛莱科技有限责任公司028-64159575 · [email protected]
山东博宇生物技术有限公司13356310019 · [email protected]
常州优瑞医药科技有限公司18168818882 · [email protected]
上海皓元医药股份有限公司021-58950125 · [email protected]
Related reactions
3 records
Compound notes
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