Home Halogens Dimethyl 2,5-dibromohexanedioate

Dimethyl 2,5-dibromohexanedioate

CAS No.:
868-72-4
Catalog Number:
AG0036BK
Molecular Formula:
C8H12Br2O4
Molecular Weight:
331.9865
Pack Size
Purity
Availability
Location
Price(USD)
Quantity
  
1g
95%
In Stock USA
United States
$32
- +
5g
95%
In Stock USA
United States
$144
- +
25g
95%
In Stock USA
United States
$464
- +
100g
95%
In Stock USA
United States
$1130
- +
Product Description
Catalog Number:
AG0036BK
Chemical Name:
Dimethyl 2,5-dibromohexanedioate
CAS Number:
868-72-4
Molecular Formula:
C8H12Br2O4
Molecular Weight:
331.9865
MDL Number:
MFCD00043758
IUPAC Name:
dimethyl 2,5-dibromohexanedioate
InChI:
InChI=1S/C8H12Br2O4/c1-13-7(11)5(9)3-4-6(10)8(12)14-2/h5-6H,3-4H2,1-2H3
InChI Key:
HVICCJCVLLCDFQ-UHFFFAOYSA-N
SMILES:
COC(=O)C(CCC(C(=O)OC)Br)Br
Properties
Complexity:
186  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
331.908g/mol
Formal Charge:
0
Heavy Atom Count:
14  
Hydrogen Bond Acceptor Count:
4  
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
331.988g/mol
Monoisotopic Mass:
329.91g/mol
Rotatable Bond Count:
7  
Topological Polar Surface Area:
52.6A^2
Undefined Atom Stereocenter Count:
2  
Undefined Bond Stereocenter Count:
0
XLogP3:
2.4  
Properties