1-[2-hydroxy-3-propyl-4-[4-(2H-tetrazol-5-yl)butoxy]phenyl]ethanone


Chemical Name: 1-[2-hydroxy-3-propyl-4-[4-(2H-tetrazol-5-yl)butoxy]phenyl]ethanone
CAS Number: 88107-10-2
Product Number: AG004G2U(AGN-PC-0JK6PZ)
Synonyms:
MDL No: MFCD00211057
Molecular Formula: C16H22N4O3
Molecular Weight: 318.3709

Identification/Properties


Computed Properties
Molecular Weight:
318.377g/mol
XLogP3:
3.7
Hydrogen Bond Donor Count:
2
Hydrogen Bond Acceptor Count:
6
Rotatable Bond Count:
9
Exact Mass:
318.169g/mol
Monoisotopic Mass:
318.169g/mol
Topological Polar Surface Area:
101A^2
Heavy Atom Count:
23
Formal Charge:
0
Complexity:
369
Isotope Atom Count:
0
Defined Atom Stereocenter Count:
0
Undefined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
Covalently-Bonded Unit Count:
1
Compound Is Canonicalized:
Yes

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NMR Spectrum


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