Home Halogens methyl 2-chloro-3-iodo-4-methylbenzoate

methyl 2-chloro-3-iodo-4-methylbenzoate

CAS No.:
914643-09-7
Catalog Number:
AG01DJOU
Molecular Formula:
C9H8ClIO2
Molecular Weight:
310.5161
Pack Size
Purity
Availability
Location
Price(USD)
Quantity
  
100mg
95%
In Stock USA
United States
$147
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Product Description
Catalog Number:
AG01DJOU
Chemical Name:
methyl 2-chloro-3-iodo-4-methylbenzoate
CAS Number:
914643-09-7
Molecular Formula:
C9H8ClIO2
Molecular Weight:
310.5161
MDL Number:
MFCD30295000
IUPAC Name:
methyl 2-chloro-3-iodo-4-methylbenzoate
InChI:
InChI=1S/C9H8ClIO2/c1-5-3-4-6(9(12)13-2)7(10)8(5)11/h3-4H,1-2H3
InChI Key:
CJNFORDSNLJDJO-UHFFFAOYSA-N
SMILES:
COC(=O)c1ccc(c(c1Cl)I)C
Properties
Complexity:
198  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
309.926g/mol
Formal Charge:
0
Heavy Atom Count:
13  
Hydrogen Bond Acceptor Count:
2  
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
310.515g/mol
Monoisotopic Mass:
309.926g/mol
Rotatable Bond Count:
2  
Topological Polar Surface Area:
26.3A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
3.4  
Properties