Chem Para Nitro Benzoic Acid

Compound 39
  CheckMol                        TMF02:r0:m0
MF=C7H5NO4 MW=167.12
 12 12  0  1  0               999 V2000
    0.0000   -0.0000   -0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
   -1.3075    0.7539   -0.0000 N   0  0  0  0  0  0  0  0  0  0  0  0
   -1.3193    2.2616   -0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
   -2.6150    0.0236   -0.0000 C   0 00  0  0  0  0  0  0  0  0  0  0
   -3.9225    0.7892   -0.0000 C   0 00  0  0  0  0  0  0  0  0  0  0
   -2.6268   -1.4606   -0.0000 C   0 00  0  0  0  0  0  0  0  0  0  0
   -5.2300    0.0589   -0.0000 C   0 00  0  0  0  0  0  0  0  0  0  0
   -3.9343   -2.1910   -0.0000 C   0 00  0  0  0  0  0  0  0  0  0  0
   -5.2418   -1.4253   -0.0000 C   0 00  0  0  0  0  0  0  0  0  0  0
   -6.5493   -2.1556   -0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -7.8568   -1.4017   -0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
   -6.5611   -3.6398   -0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
  1  2  2  0  0  0  0
  2  3  1  0  0  0  0
  2  4  1  0  0  0  0
  4  5 02  0  1  0  0
  4  6 01  0  1  0  0
  5  7 01  0  1  0  0
  6  8 02  0  1  0  0
  7  9 02  0  1  0  0
  9 10  1  0  0  0  0
 10 11  2  0  0  0  0
 10 12  1  0  0  0  0
  8  9 01  0  1  0  0
M  CHG  1   2   1
M  CHG  1   3  -1
M  END

Para nitro benzoic acid

₹ 0.00 0.00

Chemical Name - Para nitro benzoic acid
Mol Weight - 167.12
Smiles - [O-][N+](c(cc1)ccc1C(O)=O)=O

Property Name	Property Value
Mol Name	Para nitro benzoic acid
Molweight	167.12
Monoisotopic Mass	167.021859
Clogp	0.2231
Clogs	-2.089
H Acceptors	5
H Donors	1
Total Surface Area	121.03
Relative Psa	0.46732
Polar Surface Area	83.12
Druglikeness	-6.9461
Mutagenic	none
Tumorigenic	none
Reproductive Effective	high
Irritant	high
Shape Index	0.66667
Molecular Flexibility	0.48392
Molecular Complexity	0.58773
Fragments	1
Non H Atoms	12
Non Ch Atoms	5
Electronegative Atoms	5
Rotatable Bonds	2
Rings Closures	1
Small Rings	1
Aromatic Rings	1
Aromatic Atoms	6
Sp3 Atoms	2
Symmetric Atoms	2
Acidic Oxygens	2
Smiles	[O-][N+](c(cc1)ccc1C(O)=O)=O
InChIKey

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 - Para nitro benzoic acid
2 - Para nitro benzoic acid

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

Para nitro benzoic acid