Chem 2 4 Chlorobenzoyl Benzoic Acid

Compound 23
  CheckMol                        TMF02:r0:m0
MF=C14H9ClO3 MW=260.68
 18 19  0  2  0               999 V2000
    0.0000   -0.0000   -0.0000 Cl  0  0  0  0  0  0  0  0  0  0  0  0
   -1.3048    0.7523   -0.0000 C   0 00  0  0  0  0  0  0  0  0  0  0
   -1.3165    2.2569   -0.0000 C   0 00  0  0  0  0  0  0  0  0  0  0
   -2.6096    0.0235   -0.0000 C   0 00  0  0  0  0  0  0  0  0  0  0
   -2.6213    3.0092   -0.0000 C   0 00  0  0  0  0  0  0  0  0  0  0
   -3.9143    0.7758   -0.0000 C   0 00  0  0  0  0  0  0  0  0  0  0
   -3.9261    2.2804   -0.0000 C   0 00  0  0  0  0  0  0  0  0  0  0
   -5.2309    3.0327   -0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -5.2426    4.5374   -0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
   -6.5357    2.3039   -0.0000 C   0 00  0  0  0  0  0  0  0  0  0  0
   -7.8405    3.0680   -0.0000 C   0 00  0  0  0  0  0  0  0  0  0  0
   -6.5474    0.8228   -0.0000 C   0 00  0  0  0  0  0  0  0  0  0  0
   -7.8522    4.5726   -0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -9.1452    2.3392   -0.0000 C   0 00  0  0  0  0  0  0  0  0  0  0
   -7.8522    0.0940   -0.0000 C   0 00  0  0  0  0  0  0  0  0  0  0
   -6.5709    5.3249   -0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
   -9.1570    5.3367   -0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
   -9.1570    0.8581   -0.0000 C   0 00  0  0  0  0  0  0  0  0  0  0
  1  2  1  0  0  0  0
  2  3 02  0  1  0  0
  2  4 01  0  1  0  0
  3  5 01  0  1  0  0
  4  6 02  0  1  0  0
  5  7 02  0  1  0  0
  7  8  1  0  0  0  0
  8  9  2  0  0  0  0
  8 10  1  0  0  0  0
 10 11 02  0  1  0  0
 10 12 01  0  1  0  0
 11 13  1  0  0  0  0
 11 14 01  0  1  0  0
 12 15 02  0  1  0  0
 13 16  2  0  0  0  0
 13 17  1  0  0  0  0
 14 18 02  0  1  0  0
  6  7 01  0  1  0  0
 15 18 01  0  1  0  0
M  END

2-(4-Chlorobenzoyl) Benzoic Acid

₹ 0.00 0.00

Chemical Name - 2-(4-Chlorobenzoyl) Benzoic Acid
Mol Weight - 260.675
Smiles - OC(c(cccc1)c1C(c(cc1)ccc1Cl)=O)=O

Property Name	Property Value
Mol Name	2-(4-Chlorobenzoyl) Benzoic Acid
Molweight	260.675
Monoisotopic Mass	260.024022
Clogp	2.8807
Clogs	-4.465
H Acceptors	3
H Donors	1
Total Surface Area	190.29
Relative Psa	0.2059
Polar Surface Area	54.37
Druglikeness	-1.0427
Mutagenic	none
Tumorigenic	none
Reproductive Effective	none
Irritant	none
Shape Index	0.55556
Molecular Flexibility	0.51693
Molecular Complexity	0.74264
Fragments	1
Non H Atoms	18
Non Ch Atoms	4
Electronegative Atoms	4
Rotatable Bonds	3
Rings Closures	2
Small Rings	2
Aromatic Rings	2
Aromatic Atoms	12
Sp3 Atoms	1
Symmetric Atoms	2
Acidic Oxygens	1
Smiles	OC(c(cccc1)c1C(c(cc1)ccc1Cl)=O)=O
InChIKey	InChI=1S/C14H9ClO3/c15-10-7-5-9(6-8-10)13(16)11-3-1-2-4-12(11)14(17)18/h1-8H,(H,17,18)
InChI	YWECCEXWKFHHQJ-UHFFFAOYSA-N

Copyrights

The copyrights of data, design, and listing all reserved to Global Manufacturers and its associated sites.

Company profile , trade leads and products are user generated content.

Molecule Properties are generated theoretically any objection please contact us

Shipping

Usually delivered in 3-4 days

Enter pincode for exact delivery dates/charges

Credit / Debit Card Payment

We accept all major credit / debit card for payment, you can also pay through online banking.

Cash On Delivery

If Available. Select Cash on Delivery (CoD) payment option while placing the order and later, pay in cash at the time of actual delivery of product. No advance payment needed.

Click to Load Molecule
1 - 2-(4-Chlorobenzoyl) Benzoic Acid
2 - 2-(4-Chlorobenzoyl) Benzoic Acid

Chemryt - We contribute to the Chemicals, Pharmaceutical & Biotech industry using information technology

2-(4-Chlorobenzoyl) Benzoic Acid