Home Other Building Blocks 1,3,5-Triacetylbenzene

1,3,5-Triacetylbenzene

CAS No.:
779-90-8
Catalog Number:
AG003DGC
Molecular Formula:
C12H12O3
Molecular Weight:
204.2219
Pack Size
Purity
Availability
Location
Price(USD)
Quantity
  
1g
98%
In Stock USA
United States
$63
- +
5g
98%
In Stock USA
United States
$148
- +
10g
98%
In Stock USA
United States
$265
- +
25g
98%
In Stock USA
United States
$514
- +
Product Description
Catalog Number:
AG003DGC
Chemical Name:
1,3,5-Triacetylbenzene
CAS Number:
779-90-8
Molecular Formula:
C12H12O3
Molecular Weight:
204.2219
MDL Number:
MFCD00008741
IUPAC Name:
1-(3,5-diacetylphenyl)ethanone
InChI:
InChI=1S/C12H12O3/c1-7(13)10-4-11(8(2)14)6-12(5-10)9(3)15/h4-6H,1-3H3
InChI Key:
HSOAIPRTHLEQFI-UHFFFAOYSA-N
SMILES:
CC(=O)c1cc(cc(c1)C(=O)C)C(=O)C
EC Number:
212-302-1
UNII:
9K53727S7G
NSC Number:
61943
Properties
Complexity:
234  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
204.079g/mol
Formal Charge:
0
Heavy Atom Count:
15  
Hydrogen Bond Acceptor Count:
3  
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
204.225g/mol
Monoisotopic Mass:
204.079g/mol
Rotatable Bond Count:
3  
Topological Polar Surface Area:
51.2A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
1  
Properties