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85771-11-5 | 1-(2-AMINOETHYLAMINO)ETHANOL
CAS No: 85771-11-5 Catalog No: AG004OSG MDL No:MFCD19207672
Product Description
Catalog Number:
AG004OSG
Chemical Name:
1-(2-AMINOETHYLAMINO)ETHANOL
CAS Number:
85771-11-5
Molecular Formula:
C4H12N2O
Molecular Weight:
104.1509
MDL Number:
MFCD19207672
IUPAC Name:
1-(2-aminoethylamino)ethanol
InChI:
InChI=1S/C4H12N2O/c1-4(7)6-3-2-5/h4,6-7H,2-3,5H2,1H3
InChI Key:
IRTOOLQOINXNHY-UHFFFAOYSA-N
SMILES:
CC(NCCN)O
Properties
Complexity:
40.7
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
104.095g/mol
Formal Charge:
0
Heavy Atom Count:
7
Hydrogen Bond Acceptor Count:
3
Hydrogen Bond Donor Count:
3
Isotope Atom Count:
0
Molecular Weight:
104.153g/mol
Monoisotopic Mass:
104.095g/mol
Rotatable Bond Count:
3
Topological Polar Surface Area:
58.3A^2
Undefined Atom Stereocenter Count:
1
Undefined Bond Stereocenter Count:
0
XLogP3:
-1.3
Literature
| Title | Journal |
|---|---|
| Developmental sensitivity to the induction of great vessel malformations by N-(2-aminoethyl)ethanolamine. | Birth defects research. Part B, Developmental and reproductive toxicology 20120401 |
| Malformations of the great vessels in the neonatal rat induced by N-(2-aminoethyl)ethanolamine. | Birth defects research. Part B, Developmental and reproductive toxicology 20120401 |
| Toxicokinetic profile of N-(2-aminoethyl)ethanolamine in the female Wistar rat and distribution into the late gestation fetus and milk. | Birth defects research. Part B, Developmental and reproductive toxicology 20120401 |
| Aerobic biodegradation of amines in industrial saline wastewaters. | Chemosphere 20111101 |
| A liquid chromatography-electrospray ionization-tandem mass spectrometry study of ethanolamines in high salinity industrial wastewaters. | Talanta 20100115 |
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