Home Other Building Blocks 4-Hydroxy-2,5-dimethylhexan-3-one

4-Hydroxy-2,5-dimethylhexan-3-one

CAS No.:
815-77-0
Catalog Number:
AG0038FA
Molecular Formula:
C8H16O2
Molecular Weight:
144.2114
Pack Size
Purity
Availability
Location
Price(USD)
Quantity
  
250mg
95%
1 week
United States
$202
- +
1g
95%
1 week
United States
$448
- +
Product Description
Catalog Number:
AG0038FA
Chemical Name:
4-Hydroxy-2,5-dimethylhexan-3-one
CAS Number:
815-77-0
Molecular Formula:
C8H16O2
Molecular Weight:
144.2114
MDL Number:
MFCD00008920
IUPAC Name:
4-hydroxy-2,5-dimethylhexan-3-one
InChI:
InChI=1S/C8H16O2/c1-5(2)7(9)8(10)6(3)4/h5-7,9H,1-4H3
InChI Key:
SMYRRYXXNJLYLY-UHFFFAOYSA-N
SMILES:
CC(C(=O)C(C(C)C)O)C
NSC Number:
23088
Properties
Complexity:
116  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
144.115g/mol
Formal Charge:
0
Heavy Atom Count:
10  
Hydrogen Bond Acceptor Count:
2  
Hydrogen Bond Donor Count:
1  
Isotope Atom Count:
0
Molecular Weight:
144.214g/mol
Monoisotopic Mass:
144.115g/mol
Rotatable Bond Count:
3  
Topological Polar Surface Area:
37.3A^2
Undefined Atom Stereocenter Count:
1  
Undefined Bond Stereocenter Count:
0
XLogP3:
1.7  
Properties