Welcome to LookChem.com Sign In|Join Free
  • or
Home > Products >  > 

7-Nitroisatin

Related Products

Hot Products

Name

7-Nitroisatin

EINECS N/A
CAS No. 112656-95-8 Density 1.609 g/cm3
PSA 91.99000 LogP 1.39080
Solubility N/A Melting Point 240 °C
Formula C8H4N2O4 Boiling Point N/A
Molecular Weight 192.131 Flash Point N/A
Transport Information N/A Appearance N/A
Safety Risk Codes N/A
Molecular Structure Molecular Structure of 112656-95-8 (7-NITROISATIN) Hazard Symbols N/A
Synonyms

Isatin,7-nitro- (6CI);7-Nitro-1H-indole-2,3-dione;

Article Data 8

7-Nitroisatin Specification

The 1H-Indole-2, 3-dione, 7-nitro-, with the CAS registry number of 112656-95-8, is also known as 7-Nitroisatin. This chemical's molecular formula is C8H4N2O4 and molecular weight is 192.13. What's more, its systematic name is 7-Nitro-1H-indole-2, 3-dione.

Physical properties about 1H-Indole-2, 3-dione, 7-nitro- are: (1)ACD/LogP: 0.81; (2)# of Rule of 5 Violations: 0; (3)ACD/LogD (pH 5.5): 0.81; (4)ACD/LogD (pH 7.4): 0.71; (5)ACD/BCF (pH 5.5): 2.42; (6)ACD/BCF (pH 7.4): 1.93; (7)ACD/KOC (pH 5.5): 65.5; (8)ACD/KOC (pH 7.4): 52.23; (9)#H bond acceptors: 6; (10)#H bond donors: 1; (11)#Freely Rotating Bonds: 1; (12)Polar Surface Area: 83.2 Å2; (13)Index of Refraction: 1.657; (14)Molar Refractivity: 43.97 cm3; (15)Molar Volume: 119.3 cm3; (16)Surface Tension: 72.2 dyne/cm; (17)Density: 1.609 g/cm3.

You can still convert the following datas into molecular structure:
(1) SMILES: [O-][N+](=O)c1cccc2c1NC(=O)C2=O
(2) InChI: InChI=1/C8H4N2O4/c11-7-4-2-1-3-5(10(13)14)6(4)9-8(7)12/h1-3H,(H,9,11,12)
(3) InChIKey: GVZRFFXBGZSJTH-UHFFFAOYAC

Post a RFQ

Enter 15 to 2000 letters.Word count: 0 letters

Attach files(File Format: Jpeg, Jpg, Gif, Png, PDF, PPT, Zip, Rar,Word or Excel Maximum File Size: 3MB)

1

What can I do for you?
Get Best Price

Get Best Price for 112656-95-8