Home Other Building Blocks 4-Hydroxy-1-(3-pyridyl)-1-butanone (3,3,4,4-D4)

4-Hydroxy-1-(3-pyridyl)-1-butanone (3,3,4,4-D4)

CAS No.:
359435-75-9
Catalog Number:
AG00C9GQ
Molecular Formula:
Molecular Weight:
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Product Description
Catalog Number:
AG00C9GQ
Chemical Name:
4-Hydroxy-1-(3-pyridyl)-1-butanone (3,3,4,4-D4)
CAS Number:
359435-75-9
MDL Number:
MFCD02094258
IUPAC Name:
3,3,4,4-tetradeuterio-4-hydroxy-1-pyridin-3-ylbutan-1-one
InChI:
InChI=1S/C9H11NO2/c11-6-2-4-9(12)8-3-1-5-10-7-8/h1,3,5,7,11H,2,4,6H2/i2D2,6D2
InChI Key:
KTXUGZHJVRHQGP-QLYAIYELSA-N
Properties
Complexity:
148  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
169.104g/mol
Formal Charge:
0
Heavy Atom Count:
12  
Hydrogen Bond Acceptor Count:
3  
Hydrogen Bond Donor Count:
1  
Isotope Atom Count:
4  
Molecular Weight:
169.216g/mol
Monoisotopic Mass:
169.104g/mol
Rotatable Bond Count:
4  
Topological Polar Surface Area:
50.2A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
0
Properties