Home Halogens Dimethyl 5-chloroisophthalate

Dimethyl 5-chloroisophthalate

CAS No.:
20330-90-9
Catalog Number:
AG0028SK
Molecular Formula:
C10H9ClO4
Molecular Weight:
228.6291
Pack Size
Purity
Availability
Location
Price(USD)
Quantity
  
1g
98%
In Stock USA
United States
$38
- +
5g
98%
In Stock USA
United States
$88
- +
25g
98%
In Stock USA
United States
$350
- +
Product Description
Catalog Number:
AG0028SK
Chemical Name:
Dimethyl 5-chloroisophthalate
CAS Number:
20330-90-9
Molecular Formula:
C10H9ClO4
Molecular Weight:
228.6291
MDL Number:
MFCD00079752
IUPAC Name:
dimethyl 5-chlorobenzene-1,3-dicarboxylate
InChI:
InChI=1S/C10H9ClO4/c1-14-9(12)6-3-7(10(13)15-2)5-8(11)4-6/h3-5H,1-2H3
InChI Key:
CMMPMNSOVLQGMJ-UHFFFAOYSA-N
SMILES:
COC(=O)c1cc(Cl)cc(c1)C(=O)OC
NSC Number:
13963
Properties
Complexity:
230  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
228.019g/mol
Formal Charge:
0
Heavy Atom Count:
15  
Hydrogen Bond Acceptor Count:
4  
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
228.628g/mol
Monoisotopic Mass:
228.019g/mol
Rotatable Bond Count:
4  
Topological Polar Surface Area:
52.6A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
2.3  
Properties