Compound 113
  CheckMol                        TMF02:r0:m0
MF=C8H7IO2 MW=262.05
 11 11  0  1  0               999 V2000
    0.0000   -0.0000   -0.0000 I   0  0  0  0  0  0  0  0  0  0  0  0
   -1.3058   -0.7411   -0.0000 C   0 00  0  0  0  0  0  0  0  0  0  0
   -2.6117    0.0118   -0.0000 C   0 00  0  0  0  0  0  0  0  0  0  0
   -1.3176   -2.2234   -0.0000 C   0 00  0  0  0  0  0  0  0  0  0  0
   -3.9175   -0.7294   -0.0000 C   0 00  0  0  0  0  0  0  0  0  0  0
   -2.6234   -2.9646   -0.0000 C   0 00  0  0  0  0  0  0  0  0  0  0
   -3.9292   -2.2117   -0.0000 C   0 00  0  0  0  0  0  0  0  0  0  0
   -5.2351   -2.9528   -0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -6.5409   -2.1999   -0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -6.5527   -0.6941   -0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
   -7.8467   -2.9411   -0.0000 O   0  0  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  1  0  0  0  0
  9 10  2  0  0  0  0
  9 11  1  0  0  0  0
  6  7 01  0  1  0  0
M  END

2D Structure

4-Iodo phenylacetic acid

₹ 0.00 0.00

Request Quote

Chemical Name - 4-Iodo phenylacetic acid
Mol Weight - 262.042
Smiles - OC(Cc(cc1)ccc1I)=O

Property Name	Property Value
Mol Name	4-Iodo phenylacetic acid
Molweight	262.042
Monoisotopic Mass	261.949078
Clogp	1.5799
Clogs	-2.61
H Acceptors	2
H Donors	1
Total Surface Area	137.4
Relative Psa	0.19025
Polar Surface Area	37.3
Druglikeness	-0.89893
Mutagenic	none
Tumorigenic	none
Reproductive Effective	none
Irritant	none
Shape Index	0.72727
Molecular Flexibility	0.52381
Molecular Complexity	0.63561
Fragments	1
Non H Atoms	11
Non Ch Atoms	3
Electronegative Atoms	3
Rotatable Bonds	2
Rings Closures	1
Small Rings	1
Aromatic Rings	1
Aromatic Atoms	6
Sp3 Atoms	2
Symmetric Atoms	2
Acidic Oxygens	1
Smiles	OC(Cc(cc1)ccc1I)=O
InChIKey	InChI=1S/C8H7IO2/c9-7-3-1-6(2-4-7)5-8(10)11/h1-4H,5H2,(H,10,11)
InChI	FJSHTWVDFAUNCO-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 cards 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 pay in cash at the time of actual delivery. No advance payment needed.

1 — 4-Iodo phenylacetic acid | 2 — 4-Iodo phenylacetic acid