Home Other Building Blocks 1-(4-Butylphenyl)ethan-1-one

1-(4-Butylphenyl)ethan-1-one

CAS No.:
37920-25-5
Catalog Number:
AG003CYO
Molecular Formula:
C12H16O
Molecular Weight:
176.2548
Pack Size
Purity
Availability
Location
Price(USD)
Quantity
  
5g
95%
In Stock USA
United States
$38
- +
25g
>97%
In Stock USA
United States
$83
- +
Product Description
Catalog Number:
AG003CYO
Chemical Name:
1-(4-Butylphenyl)ethan-1-one
CAS Number:
37920-25-5
Molecular Formula:
C12H16O
Molecular Weight:
176.2548
MDL Number:
MFCD00017500
IUPAC Name:
1-(4-butylphenyl)ethanone
InChI:
InChI=1S/C12H16O/c1-3-4-5-11-6-8-12(9-7-11)10(2)13/h6-9H,3-5H2,1-2H3
InChI Key:
MQESVSITPLILCO-UHFFFAOYSA-N
SMILES:
CCCCc1ccc(cc1)C(=O)C
EC Number:
253-715-7
UNII:
6738CF9Z8V
Properties
Complexity:
155  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
176.12g/mol
Formal Charge:
0
Heavy Atom Count:
13  
Hydrogen Bond Acceptor Count:
1  
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
176.259g/mol
Monoisotopic Mass:
176.12g/mol
Rotatable Bond Count:
4  
Topological Polar Surface Area:
17.1A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
3.4  
Properties