Home > Compound List > Compound details
110-72-5 molecular structure
click picture or here to close

(2-aminoethyl)(ethyl)amine

ChemBase ID: 91073
Molecular Formular: C4H12N2
Molecular Mass: 88.15148
Monoisotopic Mass: 88.10004839
SMILES and InChIs

SMILES:
N(CCN)CC
Canonical SMILES:
NCCNCC
InChI:
InChI=1S/C4H12N2/c1-2-6-4-3-5/h6H,2-5H2,1H3
InChIKey:
SCZVXVGZMZRGRU-UHFFFAOYSA-N

Cite this record

CBID:91073 http://www.chembase.cn/molecule-91073.html

Collapse All Expand All

NAMES AND DATABASE IDS

NAMES AND DATABASE IDS

Names Database IDs
IUPAC name
(2-aminoethyl)(ethyl)amine
IUPAC Traditional name
1,2-ethanediamine, N-ethyl-
Synonyms
2-Ethylaminoethylamine
2-ETHYLETHYLENEDIAMINE
2-Ethylaminoethylamine
N-Ethylethylenediamine
2-(Ethylamino)ethylamine
2-乙氨基乙胺
N-乙基乙二胺
CAS Number
110-72-5
EC Number
203-795-4
MDL Number
MFCD00008166
Beilstein Number
1098272
PubChem SID
24847754
162077777
24845414
PubChem CID
66071

CALCULATED PROPERTIES

CALCULATED PROPERTIES

JChem
H Acceptors H Donor
LogD (pH = 5.5) -5.4251704  LogD (pH = 7.4) -3.4254284 
Log P -0.6330543  Molar Refractivity 27.3918 cm3
Polarizability 11.1656475 Å3 Polar Surface Area 38.05 Å2
Rotatable Bonds Lipinski's Rule of Five true 

PROPERTIES

PROPERTIES

Physical Property Safety Information Product Information Bioassay(PubChem)
Boiling Point
128-130 °C(lit.) expand Show data source
128-130°C expand Show data source
128-130°C expand Show data source
Flash Point
10 °C expand Show data source
10°C expand Show data source
34°C(93°F) expand Show data source
50 °F expand Show data source
Density
0.837 expand Show data source
0.837 g/mL at 25 °C(lit.) expand Show data source
Refractive Index
1.4400 expand Show data source
n20/D 1.439 expand Show data source
n20/D 1.439(lit.) expand Show data source
Storage Warning
Air Sensitive expand Show data source
Highly Flammable/Corrosive/Air Sensitive/Store under Argon/Keep Cold expand Show data source
European Hazard Symbols
Corrosive Corrosive (C) expand Show data source
UN Number
2734 expand Show data source
UN2733 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
3 expand Show data source
8 expand Show data source
Packing Group
2 expand Show data source
III expand Show data source
Risk Statements
10-34 expand Show data source
10-34-43 expand Show data source
Safety Statements
26-36/37/39-45 expand Show data source
9-16-20-23-26-33-36/37/39-45-60 expand Show data source
TSCA Listed
expand Show data source
GHS Pictograms
GHS02 expand Show data source
GHS05 expand Show data source
GHS08 expand Show data source
GHS Signal Word
Danger expand Show data source
GHS Hazard statements
H225-H314-H334 expand Show data source
H314-H318-H226 expand Show data source
GHS Precautionary statements
P210-P241-P303+P361+P353-P305+P351+P338-P405-P501A expand Show data source
P210-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 2734 8/PG 2 expand Show data source
Purity
≥98.0% (GC) expand Show data source
98% expand Show data source
Grade
purum expand Show data source
Certificate of Analysis
Download expand Show data source
Linear Formula
C2H5NHCH2CH2NH2 expand Show data source

DETAILS

DETAILS

MP Biomedicals MP Biomedicals Sigma Aldrich Sigma Aldrich
MP Biomedicals - 05213341 external link
MP Biomedicals Rare Chemical collection
Sigma Aldrich - 127000 external link
Packaging
5, 25 g in glass bottle

REFERENCES

REFERENCES

From Suppliers Google Scholar IconGoogle Scholar PubMed iconPubMed Google Books IconGoogle Books
    No data available
  • Searching...Please wait...

PATENTS

PATENTS

PubChem iconPubChem Patent Google Patent Search IconGoogle Patent

INTERNET

INTERNET

Baidu iconBaidu google iconGoogle