Home Other Building Blocks 3-Chloro-5-hydroxy-2-pentanon acetate

3-Chloro-5-hydroxy-2-pentanon acetate

CAS No.:
13051-49-5
Catalog Number:
AG000UJ2
Molecular Formula:
C7H11ClO3
Molecular Weight:
178.6134
Pack Size
Purity
Availability
Location
Price(USD)
Quantity
  
250mg
95%(GC)
In Stock USA
United States
$185
- +
1g
95%(GC)
In Stock USA
United States
$433
- +
5g
95%(GC)
In Stock USA
United States
$1261
- +
Product Description
Catalog Number:
AG000UJ2
Chemical Name:
3-Chloro-5-hydroxy-2-pentanon acetate
CAS Number:
13051-49-5
Molecular Formula:
C7H11ClO3
Molecular Weight:
178.6134
MDL Number:
MFCD00068821
IUPAC Name:
(3-chloro-4-oxopentyl) acetate
InChI:
InChI=1S/C7H11ClO3/c1-5(9)7(8)3-4-11-6(2)10/h7H,3-4H2,1-2H3
InChI Key:
LQKQGYIKTRJVJF-UHFFFAOYSA-N
SMILES:
CC(=O)OCCC(C(=O)C)Cl
EC Number:
235-930-8
Properties
Complexity:
156  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
178.04g/mol
Formal Charge:
0
Heavy Atom Count:
11  
Hydrogen Bond Acceptor Count:
3  
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
178.612g/mol
Monoisotopic Mass:
178.04g/mol
Rotatable Bond Count:
5  
Topological Polar Surface Area:
43.4A^2
Undefined Atom Stereocenter Count:
1  
Undefined Bond Stereocenter Count:
0
XLogP3:
0.9  
Properties