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32776-21-9 molecular structure
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ethyl[2-(piperidin-1-yl)ethyl]amine

ChemBase ID: 307057
Molecular Formular: C9H20N2
Molecular Mass: 156.2685
Monoisotopic Mass: 156.16264865
SMILES and InChIs

SMILES:
N1(CCNCC)CCCCC1
Canonical SMILES:
CCNCCN1CCCCC1
InChI:
InChI=1S/C9H20N2/c1-2-10-6-9-11-7-4-3-5-8-11/h10H,2-9H2,1H3
InChIKey:
XUHUOUMBXWRQQH-UHFFFAOYSA-N

Cite this record

CBID:307057 http://www.chembase.cn/molecule-307057.html

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NAMES AND DATABASE IDS

NAMES AND DATABASE IDS

Names Database IDs
IUPAC name
ethyl[2-(piperidin-1-yl)ethyl]amine
IUPAC Traditional name
ethyl[2-(piperidin-1-yl)ethyl]amine
Synonyms
N-ethyl-2-piperidin-1-ylethanamine
CAS Number
32776-21-9
MDL Number
MFCD08361609

DATA SOURCES

DATA SOURCES

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Data Source Data ID
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Data Source Data ID Price
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Data Source Data ID

CALCULATED PROPERTIES

CALCULATED PROPERTIES

JChem
H Acceptors H Donor
LogD (pH = 5.5) -3.6072636  LogD (pH = 7.4) -1.646706 
Log P 1.0329401  Molar Refractivity 49.6031 cm3
Polarizability 19.657892 Å3 Polar Surface Area 15.27 Å2

PROPERTIES

PROPERTIES

Bioassay(PubChem)

DETAILS

DETAILS

REFERENCES

REFERENCES

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PATENTS

PATENTS

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INTERNET

INTERNET

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