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929-59-9 molecular structure
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2-[2-(2-aminoethoxy)ethoxy]ethan-1-amine

ChemBase ID: 139926
Molecular Formular: C6H16N2O2
Molecular Mass: 148.20344
Monoisotopic Mass: 148.12117776
SMILES and InChIs

SMILES:
C(COCCOCCN)N
Canonical SMILES:
NCCOCCOCCN
InChI:
InChI=1S/C6H16N2O2/c7-1-3-9-5-6-10-4-2-8/h1-8H2
InChIKey:
IWBOPFCKHIJFMS-UHFFFAOYSA-N

Cite this record

CBID:139926 http://www.chembase.cn/molecule-139926.html

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NAMES AND DATABASE IDS

NAMES AND DATABASE IDS

Names Database IDs
IUPAC name
2-[2-(2-aminoethoxy)ethoxy]ethan-1-amine
IUPAC Traditional name
2-[2-(2-aminoethoxy)ethoxy]ethanamine
Synonyms
1,2-Bis(2-aminoethoxy)ethane
1,8-Diamino-3,6-dioxaoctane
2,2′-(Ethylenedioxy)diethylamine
2,2′-(Ethylenedioxy)bis(ethylamine)
2,2'-[1,2-Ethanediylbis(oxy)]bis-ethanamine
2,2'-(Ethylenedioxy)bis(ethylamine)
2,2'-(Ethylenedioxy)diethylamine
NSC 28972
1,8-Diaminotriethyleneglycol
2,2'-(Ethylenedioxy)bis(ethylamine)
1,2-二(2-氨基乙氧基)乙烷
1,8-二氨基-3,6-二氧杂辛烷
2,2′-(乙烯基二氧)二乙胺
2,2′-(乙烯二氧)双(乙胺)
2,2'-(亚乙基二氧)双(乙胺)
CAS Number
929-59-9
EC Number
213-203-6
MDL Number
MFCD00040474
Beilstein Number
1739187
PubChem SID
24845568
162234173
24864032
PubChem CID
70248

DATA SOURCES

DATA SOURCES

All Sources Commercial Sources Non-commercial Sources
Data Source Data ID
PubChem 70248 external link

CALCULATED PROPERTIES

CALCULATED PROPERTIES

JChem
H Acceptors H Donor
LogD (pH = 5.5) -7.4826016  LogD (pH = 7.4) -5.531225 
Log P -1.5163937  Molar Refractivity 39.9556 cm3
Polarizability 16.225592 Å3 Polar Surface Area 70.5 Å2
Rotatable Bonds Lipinski's Rule of Five true 

PROPERTIES

PROPERTIES

Physical Property Safety Information Product Information Bioassay(PubChem)
Solubility
Dimethylformamide expand Show data source
Methanol expand Show data source
Apperance
Liquid expand Show data source
Yellowish Oil expand Show data source
Boiling Point
105-109 °C/6 mmHg(lit.) expand Show data source
105-109°C/6mm expand Show data source
235-238°C expand Show data source
Flash Point
121 °C expand Show data source
121°C(250°F) expand Show data source
249.8 °F expand Show data source
Density
1.01 expand Show data source
1.015 g/mL at 25 °C(lit.) expand Show data source
Refractive Index
1.4610 expand Show data source
n20/D 1.461 expand Show data source
n20/D 1.461(lit.) expand Show data source
Storage Warning
Hygroscopic expand Show data source
European Hazard Symbols
Corrosive Corrosive (C) expand Show data source
UN Number
2735 expand Show data source
UN2735 expand Show data source
MSDS Link
Download expand Show data source
Download expand Show data source
Download expand Show data source
German water hazard class
3 expand Show data source
Hazard Class
8 expand Show data source
Packing Group
2 expand Show data source
III expand Show data source
Risk Statements
22-34-42/43 expand Show data source
34 expand Show data source
Safety Statements
20-26-36/37/39-45-60 expand Show data source
23-26-36/37/39-45 expand Show data source
TSCA Listed
expand Show data source
GHS Pictograms
GHS05 expand Show data source
GHS07 expand Show data source
GHS08 expand Show data source
GHS Signal Word
Danger expand Show data source
GHS Hazard statements
H302-H314-H317-H334 expand Show data source
H314-H318 expand Show data source
GHS Precautionary statements
P260-P303+P361+P353-P305+P351+P338-P301+P330+P331-P405-P501A expand Show data source
P261-P280-P305 + P351 + P338-P310 expand Show data source
Personal Protective Equipment
Faceshields, full-face respirator (US), Gloves, Goggles, multi-purpose combination respirator cartridge (US), type ABEK (EN14387) respirator filter expand Show data source
RID/ADR
UN 2735 8/PG 2 expand Show data source
Purity
≥96.0% (GC) expand Show data source
97+% expand Show data source
98% expand Show data source
Grade
purum expand Show data source
Certificate of Analysis
Download expand Show data source
Impurities
≤1% water expand Show data source
Linear Formula
NH2CH2CH2OCH2CH2OCH2CH2NH2 expand Show data source

DETAILS

DETAILS

Sigma Aldrich Sigma Aldrich
Sigma Aldrich - 385506 external link
Packaging
100, 500 mL in glass bottle

REFERENCES

REFERENCES

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PATENTS

PATENTS

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INTERNET

INTERNET

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