Home Aldehydes 3-Butoxybenzaldehyde

3-Butoxybenzaldehyde

CAS No.:
30609-20-2
Catalog Number:
AG00BCYB
Molecular Formula:
C11H14O2
Molecular Weight:
178.2277
Pack Size
Purity
Availability
Location
Price(USD)
Quantity
  
250mg
98%(GC)
In Stock USA
United States
$79
- +
1g
98%(GC)
In Stock USA
United States
$197
- +
5g
98%(GC)
In Stock USA
United States
$628
- +
Product Description
Catalog Number:
AG00BCYB
Chemical Name:
3-Butoxybenzaldehyde
CAS Number:
30609-20-2
Molecular Formula:
C11H14O2
Molecular Weight:
178.2277
MDL Number:
MFCD00129988
IUPAC Name:
3-butoxybenzaldehyde
InChI:
InChI=1S/C11H14O2/c1-2-3-7-13-11-6-4-5-10(8-11)9-12/h4-6,8-9H,2-3,7H2,1H3
InChI Key:
YESCIRFCEGIMED-UHFFFAOYSA-N
SMILES:
CCCCOc1cccc(c1)C=O
Properties
Complexity:
145  
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:
5  
Topological Polar Surface Area:
26.3A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
2.8  
Properties