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25114-70-9 | Ethanol, 2,2',2''-nitrilotris-, hydrobromide (1:1)
CAS No: 25114-70-9 Catalog No: AG002QJE MDL No:
Product Description
Catalog Number:
AG002QJE
Chemical Name:
Ethanol, 2,2',2''-nitrilotris-, hydrobromide (1:1)
CAS Number:
25114-70-9
Molecular Formula:
C6H16BrNO3
Molecular Weight:
230.1001
IUPAC Name:
2-[bis(2-hydroxyethyl)amino]ethanol;hydrobromide
InChI:
InChI=1S/C6H15NO3.BrH/c8-4-1-7(2-5-9)3-6-10;/h8-10H,1-6H2;1H
InChI Key:
UKKLUBWWAGMMAG-UHFFFAOYSA-N
SMILES:
OCCN(CCO)CCO.Br
EC Number:
246-629-6
Properties
Complexity:
55.7
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
2
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
229.031g/mol
Formal Charge:
0
Heavy Atom Count:
11
Hydrogen Bond Acceptor Count:
4
Hydrogen Bond Donor Count:
4
Isotope Atom Count:
0
Molecular Weight:
230.102g/mol
Monoisotopic Mass:
229.031g/mol
Rotatable Bond Count:
6
Topological Polar Surface Area:
63.9A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
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