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1177306-60-3 molecular structure
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2-(4-ethylpiperidin-1-yl)ethan-1-amine

ChemBase ID: 307386
Molecular Formular: C9H20N2
Molecular Mass: 156.2685
Monoisotopic Mass: 156.16264865
SMILES and InChIs

SMILES:
N1(CCC(CC1)CC)CCN
Canonical SMILES:
NCCN1CCC(CC1)CC
InChI:
InChI=1S/C9H20N2/c1-2-9-3-6-11(7-4-9)8-5-10/h9H,2-8,10H2,1H3
InChIKey:
IUURUDXVDZPRHL-UHFFFAOYSA-N

Cite this record

CBID:307386 http://www.chembase.cn/molecule-307386.html

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NAMES AND DATABASE IDS

NAMES AND DATABASE IDS

Names Database IDs
IUPAC name
2-(4-ethylpiperidin-1-yl)ethan-1-amine
IUPAC Traditional name
2-(4-ethylpiperidin-1-yl)ethanamine
Synonyms
2-(4-ethylpiperidin-1-yl)ethanamine
CAS Number
1177306-60-3
MDL Number
MFCD09864337

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) -3.7848964  LogD (pH = 7.4) -1.4870185 
Log P 0.97513956  Molar Refractivity 49.2295 cm3
Polarizability 19.657892 Å3 Polar Surface Area 29.26 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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