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ETHYL-D5 ALCOHOL

CAS No.:
1859-08-1
Catalog Number:
AG00AB55
Molecular Formula:
Molecular Weight:
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Product Description
Catalog Number:
AG00AB55
Chemical Name:
ETHYL-D5 ALCOHOL
CAS Number:
1859-08-1
MDL Number:
MFCD00144264
IUPAC Name:
1,1,2,2,2-pentadeuterioethanol
InChI:
InChI=1S/C2H6O/c1-2-3/h3H,2H2,1H3/i1D3,2D2
InChI Key:
LFQSCWFLJHTTHZ-ZBJDZAJPSA-N
Properties
Complexity:
2.8  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
51.073g/mol
Formal Charge:
0
Heavy Atom Count:
3  
Hydrogen Bond Acceptor Count:
1  
Hydrogen Bond Donor Count:
1  
Isotope Atom Count:
5  
Molecular Weight:
51.1g/mol
Monoisotopic Mass:
51.073g/mol
Rotatable Bond Count:
0
Topological Polar Surface Area:
20.2A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
-0.1  
Literature
Title Journal
The photoelectron spectrum of the ethoxide anion: conical intersections, the spin-orbit interaction, and sequence bands. The Journal of chemical physics 20091007
Properties