Software for chemicals, Pharmaceutical & Biotech Industry

Compound 37
  CheckMol                        TMF02:r0:m0
MF=C14H11N MW=193.25
 15 16  0  2  0               999 V2000
    0.0000   -0.0000   -0.0000 N   0  0  0  0  0  0  0  0  0  0  0  0
    1.2932   -0.7474   -0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.5864   -1.4949   -0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    3.8796   -0.7356   -0.0000 C   0 00  0  0  0  0  0  0  0  0  0  0
    2.5745   -2.9898   -0.0000 C   0 00  0  0  0  0  0  0  0  0  0  0
    5.1728   -1.4830   -0.0000 C   0 00  0  0  0  0  0  0  0  0  0  0
    3.8677    0.7830   -0.0000 C   0 00  0  0  0  0  0  0  0  0  0  0
    1.2576   -3.7254   -0.0000 C   0 00  0  0  0  0  0  0  0  0  0  0
    3.8677   -3.7372   -0.0000 C   0 00  0  0  0  0  0  0  0  0  0  0
    6.4660   -0.7237   -0.0000 C   0 00  0  0  0  0  0  0  0  0  0  0
    5.1609    1.5424   -0.0000 C   0 00  0  0  0  0  0  0  0  0  0  0
    1.2457   -5.2203   -0.0000 C   0 00  0  0  0  0  0  0  0  0  0  0
    3.8559   -5.2321   -0.0000 C   0 00  0  0  0  0  0  0  0  0  0  0
    6.4542    0.7949   -0.0000 C   0 00  0  0  0  0  0  0  0  0  0  0
    2.5389   -5.9677   -0.0000 C   0 00  0  0  0  0  0  0  0  0  0  0
  1  2  3  0  0  0  0
  2  3  1  0  0  0  0
  3  4  1  0  0  0  0
  3  5  1  0  0  0  0
  4  6 02  0  1  0  0
  4  7 01  0  1  0  0
  5  8 02  0  1  0  0
  5  9 01  0  1  0  0
  6 10 01  0  1  0  0
  7 11 02  0  1  0  0
  8 12 01  0  1  0  0
  9 13 02  0  1  0  0
 10 14 02  0  1  0  0
 12 15 02  0  1  0  0
 11 14 01  0  1  0  0
 13 15 01  0  1  0  0
M  END

Diphenyl Acetonitrile

₹ 0.00 0.00

Chemical Name - Diphenyl Acetonitrile
Mol Weight - 193.248
Smiles - N#CC(c1ccccc1)c1ccccc1

Property Name	Property Value
Mol Name	Diphenyl Acetonitrile
Molweight	193.248
Monoisotopic Mass	193.089149
Clogp	3.1923
Clogs	-3.416
H Acceptors	1
Total Surface Area	167.23
Relative Psa	0.081086
Polar Surface Area	23.79
Druglikeness	-5.4523
Mutagenic	none
Tumorigenic	high
Reproductive Effective	none
Irritant	none
Shape Index	0.6
Molecular Flexibility	0.38733
Molecular Complexity	0.48589
Fragments	1
Non H Atoms	15
Non Ch Atoms	1
Electronegative Atoms	1
Rotatable Bonds	2
Rings Closures	2
Small Rings	2
Aromatic Rings	2
Aromatic Atoms	12
Sp3 Atoms	1
Symmetric Atoms	8
Smiles	N#CC(c1ccccc1)c1ccccc1
InChIKey	InChI=1S/C14H11N/c15-11-14(12-7-3-1-4-8-12)13-9-5-2-6-10-13/h1-10,14H
InChI	NEBPTMCRLHKPOB-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 - Diphenyl Acetonitrile
2 - Diphenyl Acetonitrile

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

Diphenyl Acetonitrile