Home Other Building Blocks 4'-tert-Butylacetophenone

4'-tert-Butylacetophenone

CAS No.:
943-27-1
Catalog Number:
AG0038IW
Molecular Formula:
C12H16O
Molecular Weight:
176.2548
Pack Size
Purity
Availability
Location
Price(USD)
Quantity
  
1g
98%
In Stock USA
United States
$13
- +
5g
98%
In Stock USA
United States
$25
- +
25g
98%
In Stock USA
United States
$63
- +
100g
98%
In Stock USA
United States
$188
- +
500g
98%
In Stock USA
United States
$750
- +
Product Description
Catalog Number:
AG0038IW
Chemical Name:
4'-tert-Butylacetophenone
CAS Number:
943-27-1
Molecular Formula:
C12H16O
Molecular Weight:
176.2548
MDL Number:
MFCD00017256
IUPAC Name:
1-(4-tert-butylphenyl)ethanone
InChI:
InChI=1S/C12H16O/c1-9(13)10-5-7-11(8-6-10)12(2,3)4/h5-8H,1-4H3
InChI Key:
UYFJYGWNYQCHOB-UHFFFAOYSA-N
SMILES:
CC(=O)c1ccc(cc1)C(C)(C)C
EC Number:
213-399-3
NSC Number:
826
Properties
Complexity:
180  
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:
2  
Topological Polar Surface Area:
17.1A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
3.4  
Properties