Home Other Building Blocks 4-Chlorophenyl benzoate

4-Chlorophenyl benzoate

CAS No.:
2005-08-5
Catalog Number:
AG002CTO
Molecular Formula:
C13H9ClO2
Molecular Weight:
232.6624
Pack Size
Purity
Availability
Location
Price(USD)
Quantity
  
25g
>99.0%(GC)
1 week
United States
$231
- +
Product Description
Catalog Number:
AG002CTO
Chemical Name:
4-Chlorophenyl benzoate
CAS Number:
2005-08-5
Molecular Formula:
C13H9ClO2
Molecular Weight:
232.6624
MDL Number:
MFCD00040854
IUPAC Name:
(4-chlorophenyl) benzoate
InChI:
InChI=1S/C13H9ClO2/c14-11-6-8-12(9-7-11)16-13(15)10-4-2-1-3-5-10/h1-9H
InChI Key:
JKSIXXOEIXUYFW-UHFFFAOYSA-N
SMILES:
Clc1ccc(cc1)OC(=O)c1ccccc1
EC Number:
217-910-0
NSC Number:
406605
Properties
Complexity:
228  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
232.029g/mol
Formal Charge:
0
Heavy Atom Count:
16  
Hydrogen Bond Acceptor Count:
2  
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
232.663g/mol
Monoisotopic Mass:
232.029g/mol
Rotatable Bond Count:
3  
Topological Polar Surface Area:
26.3A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
4.2  
Properties