Benzaldehyde, 3-(1,1-dimethylethyl)-2-hydroxy-5-methoxy-


Chemical Name: Benzaldehyde, 3-(1,1-dimethylethyl)-2-hydroxy-5-methoxy-
CAS Number: 123013-13-8
Product Number: AG000JY5(AGN-PC-0N1IWQ)
Synonyms:
MDL No:
Molecular Formula: C12H16O3
Molecular Weight: 208.2536

Identification/Properties


Computed Properties
Molecular Weight:
208.257g/mol
XLogP3:
3.2
Hydrogen Bond Donor Count:
1
Hydrogen Bond Acceptor Count:
3
Rotatable Bond Count:
3
Exact Mass:
208.11g/mol
Monoisotopic Mass:
208.11g/mol
Topological Polar Surface Area:
46.5A^2
Heavy Atom Count:
15
Formal Charge:
0
Complexity:
219
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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