Home Aldehydes 3-Sec-butoxybenzaldehyde

3-Sec-butoxybenzaldehyde

CAS No.:
915924-09-3
Catalog Number:
AG00IGS2
Molecular Formula:
C11H14O2
Molecular Weight:
178.2277
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:
AG00IGS2
Chemical Name:
3-Sec-butoxybenzaldehyde
CAS Number:
915924-09-3
Molecular Formula:
C11H14O2
Molecular Weight:
178.2277
MDL Number:
MFCD08691916
IUPAC Name:
3-butan-2-yloxybenzaldehyde
InChI:
InChI=1S/C11H14O2/c1-3-9(2)13-11-6-4-5-10(7-11)8-12/h4-9H,3H2,1-2H3
InChI Key:
VDZAJWUUHHMPCY-UHFFFAOYSA-N
SMILES:
CCC(Oc1cccc(c1)C=O)C
Properties
Complexity:
156  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
178.099g/mol
Formal Charge:
0
Heavy Atom Count:
13  
Hydrogen Bond Acceptor Count:
2  
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
178.231g/mol
Monoisotopic Mass:
178.099g/mol
Rotatable Bond Count:
4  
Topological Polar Surface Area:
26.3A^2
Undefined Atom Stereocenter Count:
1  
Undefined Bond Stereocenter Count:
0
XLogP3:
2.7  
Properties