Home Halogens Methyl 4-(trichloromethyl)benzoate

Methyl 4-(trichloromethyl)benzoate

CAS No.:
14815-87-3
Catalog Number:
AG001FHL
Molecular Formula:
C9H7Cl3O2
Molecular Weight:
253.5097
Pack Size
Purity
Availability
Location
Price(USD)
Quantity
  
25g
95%
In Stock USA
United States
$494
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Product Description
Catalog Number:
AG001FHL
Chemical Name:
Methyl 4-(trichloromethyl)benzoate
CAS Number:
14815-87-3
Molecular Formula:
C9H7Cl3O2
Molecular Weight:
253.5097
MDL Number:
MFCD00511226
IUPAC Name:
methyl 4-(trichloromethyl)benzoate
InChI:
InChI=1S/C9H7Cl3O2/c1-14-8(13)6-2-4-7(5-3-6)9(10,11)12/h2-5H,1H3
InChI Key:
PWFPDRYHJFGZDV-UHFFFAOYSA-N
SMILES:
COC(=O)c1ccc(cc1)C(Cl)(Cl)Cl
EC Number:
238-886-8
Properties
Complexity:
205  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
251.951g/mol
Formal Charge:
0
Heavy Atom Count:
14  
Hydrogen Bond Acceptor Count:
2  
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
253.503g/mol
Monoisotopic Mass:
251.951g/mol
Rotatable Bond Count:
2  
Topological Polar Surface Area:
26.3A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
4  
Properties