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884497-53-4 molecular structure
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(2-methoxyethyl)(2-phenoxyethyl)amine

ChemBase ID: 311186
Molecular Formular: C11H17NO2
Molecular Mass: 195.25818
Monoisotopic Mass: 195.12592879
SMILES and InChIs

SMILES:
N(CCOC)CCOc1ccccc1
Canonical SMILES:
COCCNCCOc1ccccc1
InChI:
InChI=1S/C11H17NO2/c1-13-9-7-12-8-10-14-11-5-3-2-4-6-11/h2-6,12H,7-10H2,1H3
InChIKey:
AKZOZLOKDOIJKD-UHFFFAOYSA-N

Cite this record

CBID:311186 http://www.chembase.cn/molecule-311186.html

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NAMES AND DATABASE IDS

NAMES AND DATABASE IDS

Names Database IDs
IUPAC name
(2-methoxyethyl)(2-phenoxyethyl)amine
IUPAC Traditional name
(2-methoxyethyl)(2-phenoxyethyl)amine
Synonyms
(2-methoxyethyl)(2-phenoxyethyl)amine
CAS Number
884497-53-4
MDL Number
MFCD05863689

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) -1.6152273  LogD (pH = 7.4) -0.11659142 
Log P 1.4041957  Molar Refractivity 56.2891 cm3
Polarizability 22.432364 Å3 Polar Surface Area 30.49 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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