Home Aldehydes 4-acetylbenzaldehyde

4-acetylbenzaldehyde

CAS No.:
3457-45-2
Catalog Number:
AG003KMQ
Molecular Formula:
C9H8O2
Molecular Weight:
148.1586
Pack Size
Purity
Availability
Location
Price(USD)
Quantity
  
1g
97%
In Stock USA
United States
$229
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Product Description
Catalog Number:
AG003KMQ
Chemical Name:
4-acetylbenzaldehyde
CAS Number:
3457-45-2
Molecular Formula:
C9H8O2
Molecular Weight:
148.1586
MDL Number:
MFCD02093689
IUPAC Name:
4-acetylbenzaldehyde
InChI:
InChI=1S/C9H8O2/c1-7(11)9-4-2-8(6-10)3-5-9/h2-6H,1H3
InChI Key:
KTFKRVMXIVSARW-UHFFFAOYSA-N
SMILES:
O=Cc1ccc(cc1)C(=O)C
Properties
Complexity:
155  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
148.052g/mol
Formal Charge:
0
Heavy Atom Count:
11  
Hydrogen Bond Acceptor Count:
2  
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
148.161g/mol
Monoisotopic Mass:
148.052g/mol
Rotatable Bond Count:
2  
Topological Polar Surface Area:
34.1A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
1.2  
Properties