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Ethyl 4-decylpiperazine-1-carboxylate

HCID 228932
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Basic informationNames & identifiersPropertiesRelated reactionsCompound notes
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Basic information

CAS
63207-02-3
Standard SMILES
CCCCCCCCCCN1CCN(C(=O)OCC)CC1
InChIKey
JVOVZRZWICUORT-UHFFFAOYSA-N
Molecular formula
C17H34N2O2
Average molar mass
298.5 g/mol
Monoisotopic mass
298.26202833

Names & identifiers

Preferred name
Ethyl 4-decylpiperazine-1-carboxylate
IUPAC
ethyl 4-decylpiperazine-1-carboxylate

Names & synonyms

63207-02-3ethyl 4-decylpiperazine-1-carboxylateNSC22141SCHEMBL9047895DTXSID00281615JVOVZRZWICUORT-UHFFFAOYSA-N1-ethoxycarbonyl-4-decylpiperazineNSC-22141ethyl 4-decyl-1-piperazinecarboxylate

Database identifiers

CAS
63207-02-3
PubChem CID
228932
DTXSID
DTXSID00281615

Properties

Computed structural propertiesFilling in

XLogP
4.8
Topological polar surface area
32.8 Ų
Hydrogen bond donors
0
Hydrogen bond acceptors
3
Rotatable bonds
11
Heavy atoms
21
Formal charge
0
Complexity
264

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Related reactions

7 records
New reaction record
HRID 259066 reaction equation
HRID 259066As productuspto-grants-1977_07
HRID 259067 reaction equation
HRID 259067As reactantuspto-grants-1977_07
HRID 312791 reaction equation
HRID 312791As reactantTraining data from https://doi.org/10.1039/C8SC04228D (8/10)
HRID 1541085 reaction equation
HRID 1541085As productTraining data from https://doi.org/10.1039/C8SC04228D (1/10)
HRID 1707623 reaction equation
HRID 1707623As productuspto-grants-1994_10
HRID 2210790 reaction equation
HRID 2210790As productuspto-grants-1995_10
HRID 2324468 reaction equation
HRID 2324468As productTraining data from https://doi.org/10.1039/C8SC04228D (10/10)

Compound notes

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