Home Halogens Methyl 3-(3-chloro-4-cyanophenyl)benzoate

Methyl 3-(3-chloro-4-cyanophenyl)benzoate

CAS No.:
1355247-44-7
Catalog Number:
AG007LDT
Molecular Formula:
C15H10ClNO2
Molecular Weight:
271.6984
Pack Size
Purity
Availability
Location
Price(USD)
Quantity
  
1g
98%
In Stock USA
United States
$150
- +
5g
98%
In Stock USA
United States
$450
- +
10g
98%
In Stock USA
United States
$750
- +
Product Description
Catalog Number:
AG007LDT
Chemical Name:
Methyl 3-(3-chloro-4-cyanophenyl)benzoate
CAS Number:
1355247-44-7
Molecular Formula:
C15H10ClNO2
Molecular Weight:
271.6984
MDL Number:
MFCD21333007
IUPAC Name:
methyl 3-(3-chloro-4-cyanophenyl)benzoate
InChI:
InChI=1S/C15H10ClNO2/c1-19-15(18)12-4-2-3-10(7-12)11-5-6-13(9-17)14(16)8-11/h2-8H,1H3
InChI Key:
ZUMBDRJNLBHZBQ-UHFFFAOYSA-N
SMILES:
COC(=O)c1cccc(c1)c1ccc(c(c1)Cl)C#N
Properties
Complexity:
376  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
271.04g/mol
Formal Charge:
0
Heavy Atom Count:
19  
Hydrogen Bond Acceptor Count:
3  
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
271.7g/mol
Monoisotopic Mass:
271.04g/mol
Rotatable Bond Count:
3  
Topological Polar Surface Area:
50.1A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
3.7  
Properties