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Tert-butyl 4-(1-ethoxy-1-oxopropan-2-yl)piperidine-1-carboxylate

HCID 18670567
NotesReactions
Basic informationNames & identifiersPropertiesChemistry & industryRelated reactionsCompound notes
Substructure searchFind similar structures

Basic information

CAS
141060-29-9
Standard SMILES
CCOC(=O)C(C)C1CCN(C(=O)OC(C)(C)C)CC1
InChIKey
RNLTXXKJKMKCDZ-UHFFFAOYSA-N
Molecular formula
C15H27NO4
Average molar mass
285.38 g/mol
Monoisotopic mass
285.19400834

Names & identifiers

Preferred name
Tert-butyl 4-(1-ethoxy-1-oxopropan-2-yl)piperidine-1-carboxylate
IUPAC
tert-butyl 4-(1-ethoxy-1-oxopropan-2-yl)piperidine-1-carboxylate
English name
tert-butyl 4-(1-ethoxy-1-oxopropan-2-yl)piperidine-1-carboxylate
Molecular formula
C15H27NO4
Molecular weight
285.37918

Names & synonyms

141060-29-9Ethyl 2-(1-Boc-4-piperidinyl)propanoatetert-butyl 4-(1-ethoxy-1-oxopropan-2-yl)piperidine-1-carboxylateMFCD216070494-Piperidineacetic acid, 1-[(1,1-dimethylethoxy)carbonyl]-alpha-methyl-, ethyl esterSCHEMBL122218YQF3461RNLTXXKJKMKCDZ-UHFFFAOYSA-NDTXSID701163238AC2601AKOS037649653CS-12874
Show more names
4-Piperidineacetic acid, 1-[(1,1-dimethylethoxy)carbonyl]-α-methyl-, ethyl ester
SY2329041-Boc-4-(1-ethoxy-1-oxopropan-2-yl)piperidineF7984002-(1-tert-butoxycarbonylpiperidin-4-yl)propionic acid ethyl estertert-butyl4-(1-ethoxy-1-oxopropan-2-yl)piperidine-1-carboxylate4-(1-Ethoxycarbonylethyl)piperidine-1-carboxylic acid tert-butyl esterEthyl 1-[(1,1-dimethylethoxy)carbonyl]-I+/--methyl-4-piperidineacetatetert-butyl 4-(2-ethoxy-1-methyl-2-oxo-ethyl)piperidine-1-carboxylate

Database identifiers

CAS
141060-29-9
PubChem CID
18670567
DTXSID

Properties

Computed structural properties

XLogP
2.6
Topological polar surface area
55.8 Ų
Hydrogen bond donors
0
Hydrogen bond acceptors
4
Rotatable bonds
6
Heavy atoms
20
Formal charge
0
Complexity
340

Physicochemical properties

Boiling point
349.8 · 349.8±15.0 °C(Predicted)
Density
1.044 · 1.044±0.06 g/cm3(Predicted)
pka
-1.62 · -1.62±0.40(Predicted)

Chemistry & industry

Suppliers15 total

杭州摩库生物医药科技有限公司+86-057181025280; +8617767106207 · [email protected]
江苏艾康生物医药研发有限公司025-025-66113011 15955137747 · [email protected]
河北贝克曼生物科技有限公司15961617865 15961617865 · [email protected]
韶远科技(上海)有限公司021-50795510 4000665055 · [email protected]
艾琪康医药科技(上海)有限公司13661411401 · [email protected]
吉林中科研伸科技有限公司18143011203 · [email protected]
南通敏言生物医药科技有限公司0513-85921823 18662920231 · [email protected]
安耐吉化学&3A(安徽泽升科技股份有限公司)400-0056266 · [email protected]
南京合巨药业有限公司25-57027686 17372956142 · [email protected]
上海颖心实验室设备有限公司021-021-59178156 15300768757 · [email protected]
艾琪康医药科技(上海)有限公司13512160998; 13512160998 · [email protected]
Accela ChemBio Inc.+1-858-6993322 +86-18019713315 · [email protected]
Jilin Chinese Academy of Sciences-yanshen Technology18143011203 · [email protected]

Related reactions

6 records
New reaction record
HRID 287985 reaction equation
HRID 287985As productTraining data from https://doi.org/10.1039/C8SC04228D (8/10)
HRID 297164 reaction equation
HRID 297164As reactantTraining data from https://doi.org/10.1039/C8SC04228D (8/10)
HRID 1374144 reaction equation
HRID 1374144As productuspto-grants-2007_01
HRID 1567180 reaction equation
HRID 1567180As productTraining data from https://doi.org/10.1039/C8SC04228D (1/10)
HRID 1804839 reaction equation
HRID 1804839As productuspto-grants-2013_01
HRID 1804840 reaction equation
HRID 1804840As reactantuspto-grants-2013_01

Compound notes

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On this pageBasic informationNames & identifiersPropertiesChemistry & industryRelated reactionsCompound notes
DTXSID701163238
南通普悦生物医药有限公司
0513-0513-0513-89158300 18014392889 · [email protected]
上海鼓臣生物技术有限公司021-34675735 19147740836 · [email protected]