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90228-11-8 molecular structure
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2-[4-(2-hydroxyethyl)piperazin-1-yl]acetamide

ChemBase ID: 308773
Molecular Formular: C8H17N3O2
Molecular Mass: 187.23948
Monoisotopic Mass: 187.1320768
SMILES and InChIs

SMILES:
N1(CC(=O)N)CCN(CC1)CCO
Canonical SMILES:
OCCN1CCN(CC1)CC(=O)N
InChI:
InChI=1S/C8H17N3O2/c9-8(13)7-11-3-1-10(2-4-11)5-6-12/h12H,1-7H2,(H2,9,13)
InChIKey:
OJEUKFXLIICKDY-UHFFFAOYSA-N

Cite this record

CBID:308773 http://www.chembase.cn/molecule-308773.html

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NAMES AND DATABASE IDS

NAMES AND DATABASE IDS

Names Database IDs
IUPAC name
2-[4-(2-hydroxyethyl)piperazin-1-yl]acetamide
IUPAC Traditional name
2-[4-(2-hydroxyethyl)piperazin-1-yl]acetamide
Synonyms
2-[4-(2-hydroxyethyl)-1-piperazinyl]acetamide
CAS Number
90228-11-8
MDL Number
MFCD11505330

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) -3.9384763  LogD (pH = 7.4) -2.316043 
Log P -1.9817723  Molar Refractivity 50.2373 cm3
Polarizability 19.64174 Å3 Polar Surface Area 69.8 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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