Home Aldehydes 4-(Sec-butoxy)-3-methoxybenzaldehyde

4-(Sec-butoxy)-3-methoxybenzaldehyde

CAS No.:
722489-38-5
Catalog Number:
AG00FBS9
Molecular Formula:
C12H16O3
Molecular Weight:
208.2536
Pack Size
Purity
Availability
Location
Price(USD)
Quantity
  
1g
95%
In Stock USA
United States
$96
- +
5g
95%
In Stock USA
United States
$216
- +
Product Description
Catalog Number:
AG00FBS9
Chemical Name:
4-(Sec-butoxy)-3-methoxybenzaldehyde
CAS Number:
722489-38-5
Molecular Formula:
C12H16O3
Molecular Weight:
208.2536
MDL Number:
MFCD02629662
IUPAC Name:
4-butan-2-yloxy-3-methoxybenzaldehyde
InChI:
InChI=1S/C12H16O3/c1-4-9(2)15-11-6-5-10(8-13)7-12(11)14-3/h5-9H,4H2,1-3H3
InChI Key:
HLWKDCMKTGMQNT-UHFFFAOYSA-N
SMILES:
CCC(Oc1ccc(cc1OC)C=O)C
Properties
Complexity:
193  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
208.11g/mol
Formal Charge:
0
Heavy Atom Count:
15  
Hydrogen Bond Acceptor Count:
3  
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
208.257g/mol
Monoisotopic Mass:
208.11g/mol
Rotatable Bond Count:
5  
Topological Polar Surface Area:
35.5A^2
Undefined Atom Stereocenter Count:
1  
Undefined Bond Stereocenter Count:
0
XLogP3:
2.7  
Properties