Home Other Building Blocks 2,5-Octanedione

2,5-Octanedione

CAS No.:
3214-41-3
Catalog Number:
AG0038T4
Molecular Formula:
C8H14O2
Molecular Weight:
142.1956
Pack Size
Purity
Availability
Location
Price(USD)
Quantity
  
100mg
95%
In Stock USA
United States
$262
- +
250mg
95%
In Stock USA
United States
$523
- +
Product Description
Catalog Number:
AG0038T4
Chemical Name:
2,5-Octanedione
CAS Number:
3214-41-3
Molecular Formula:
C8H14O2
Molecular Weight:
142.1956
MDL Number:
MFCD00043716
IUPAC Name:
octane-2,5-dione
InChI:
InChI=1S/C8H14O2/c1-3-4-8(10)6-5-7(2)9/h3-6H2,1-2H3
InChI Key:
SPDFSSLYVRCMDZ-UHFFFAOYSA-N
SMILES:
CCCC(=O)CCC(=O)C
Properties
Complexity:
127  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
142.099g/mol
Formal Charge:
0
Heavy Atom Count:
10  
Hydrogen Bond Acceptor Count:
2  
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
142.198g/mol
Monoisotopic Mass:
142.099g/mol
Rotatable Bond Count:
5  
Topological Polar Surface Area:
34.1A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
0.4  
Properties