Basic information
- CAS
1257294-02-2- Standard SMILES
CCOC(=O)C(C(=O)OCC)C1CCN(C(=O)OC(C)(C)C)CC1- InChIKey
SQKHGFZJAIMEFQ-UHFFFAOYSA-N- Molecular formula
- C17H29NO6
- Average molar mass
- 343.4 g/mol
- Monoisotopic mass
- 343.19948765
Names & identifiers
- Preferred name
- Diethyl 2-(1-(tert-butoxycarbonyl)piperidin-4-yl)malonate
- IUPAC
- diethyl 2-[1-[(2-methylpropan-2-yl)oxycarbonyl]piperidin-4-yl]propanedioate
- English name
- diethyl 2-(1-(tert-butoxycarbonyl)piperidin-4-yl)Malonate
- Molecular formula
- C17H29NO6
- Molecular weight
- 343.42
Names & synonyms
1257294-02-2diethyl 2-(1-(tert-butoxycarbonyl)piperidin-4-yl)malonatediethyl 2-[1-[(2-methylpropan-2-yl)oxycarbonyl]piperidin-4-yl]propanedioateMFCD12032187SQKHGFZJAIMEFQ-UHFFFAOYSA-NSCHEMBL1873727Diethyl2-(1-(tert-butoxycarbonyl)piperidin-4-yl)malonateDTXSID10732481AKOS016845300Diethyl 2-(1-Boc-4-piperidyl)malonateSY417260DB-114324
Show more names
Propanedioic acid, 2-[1-[(1,1-dimethylethoxy)carbonyl]-4-piperidinyl]-, 1,3-diethyl ester
F51917diethyl[1-(tert-butoxycarbonyl)piperidin-4-yl]malonatediethyl [1-(tert-butoxycarbonyl)piperidin-4-yl]malonatediethyl [1-(tert-butoxycarbonyl)piperidine-4-yl]malonatediethyl[1-(tert-butoxycarbonyl)piperidine-4-yl]malonateDiethyl [1-(tert-butoxycarbonyl)piperidin-4-yl]propanedioate2-(1-(tert-Butoxycarbonyl)piperidin-4-yl)malonic acid diethyl ester
Database identifiers
- CAS
1257294-02-2- PubChem CID
- 59605280
- DTXSID
DTXSID10732481
Properties
Computed structural properties
- XLogP
- 2.5
- Topological polar surface area
- 82.1 Ų
- Hydrogen bond donors
- 0
- Hydrogen bond acceptors
- 6
- Rotatable bonds
- 9
- Heavy atoms
- 24
- Formal charge
- 0
- Complexity
- 430
Physicochemical properties
- Boiling point
- 403.5 · 403.5±15.0 °C(Predicted)
- Density
- 1.108 · 1.108±0.06 g/cm3(Predicted)
- storage temp.
- 2 · 2-8°C
- pka
- 12.49 · 12.49±0.20(Predicted)
Chemistry & industry
Suppliers5 total
NINGBOBENKANGJS PHARMTECHCO., LTD+8615990591583 15990591583
郑州药领医药科技有限公司13526569071 · [email protected]
宁波苯康基石医药科技有限公司15990591583
韶远科技(上海)有限公司021-50795510 4000665055 · [email protected]
江阴康源生物医药科技有限公司0510-86010668 · [email protected]
Related reactions
11 records
Compound notes
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