Benzaldehyde, 4-butoxy-3-methoxy-


Chemical Name: Benzaldehyde, 4-butoxy-3-methoxy-
CAS Number: 51301-87-2
Product Number: AG00D8HK(AGN-PC-0KBPOA)
Synonyms:
MDL No:
Molecular Formula: C12H16O3
Molecular Weight: 208.2536

Identification/Properties


Computed Properties
Molecular Weight:
208.257g/mol
XLogP3:
2.5
Hydrogen Bond Donor Count:
0
Hydrogen Bond Acceptor Count:
3
Rotatable Bond Count:
6
Exact Mass:
208.11g/mol
Monoisotopic Mass:
208.11g/mol
Topological Polar Surface Area:
35.5A^2
Heavy Atom Count:
15
Formal Charge:
0
Complexity:
182
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

Safety Information


GHS Pictogram:
N/A
Signal Word:
UN#:
-
Hazard Statements:
-
Precautionary Statements:
Class:
-
Packing Group:
-

NMR Spectrum


Other Analytical Data


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