1H-Indole-2,3-dione,4-bromo-7-methyl- supplier

Name
4-BROMO-7-METHYLISATIN
EINECS
CAS No. 874375-17-4
Density 1.714 g/cm³
Solubility
Melting Point
Formula C₉H₆BrNO₂
Boiling Point
Molecular Weight 240.056
Flash Point
Transport Information
Appearance
Safety
Risk Codes
Molecular Structure
Hazard Symbols
Synonyms 4-Bromo-7-methyl-indoline-2,3-dione;4-Bromo-7-methyl-1H-indole-2,3-dione;4-Bromo-7-methylisatin;4-Bromo-7-methyl-1H-benzo[d]azoline-2,3-dione;SBB065640;ZINC16123540;TL8005688;
PSA 46.17000
LogP 2.03030

1H-Indole-2,3-dione,4-bromo-7-methyl- Specification

The 1H-Indole-2,3-dione,4-bromo-7-methyl- with CAS registry number of 874375-17-4 is also known as 4-Bromo-7-methyl-indoline-2,3-dione. The IUPAC name is 4-Bromo-7-methyl-1H-indole-2,3-dione. It belongs to product categories of Isatin Series; Indane/Indanone and Derivatives. In addition, the formula is C₉H₆BrNO₂ and the molecular weight is 240.05.

Physical properties about 1H-Indole-2,3-dione,4-bromo-7-methyl- are: (1)ACD/LogP: 1.79; (2)ACD/LogD (pH 5.5): 1.79; (3)ACD/LogD (pH 7.4): 1.79; (4)#H bond acceptors: 3; (5)#H bond donors: 1; (6)Polar Surface Area: 46.17Å²; (7)Index of Refraction: 1.631; (8)Molar Refractivity: 49.93 cm³; (9)Molar Volume: 140 cm³; (10)Polarizability: 19.79×10^-24cm³; (11)Surface Tension: 54.4 dyne/cm; (12)Density: 1.714 g/cm³.

You can still convert the following datas into molecular structure:
1. SMILES: Cc2ccc(Br)c1c2NC(=O)C1=O
2. InChI: InChI=1/C9H6BrNO2/c1-4-2-3-5(10)6-7(4)11-9(13)8(6)12/h2-3H,1H3,(H,11,12,13)
3. InChIKey: VYPAAYCDBZXFOI-UHFFFAOYAW
4. Std. InChI: InChI=1S/C9H6BrNO2/c1-4-2-3-5(10)6-7(4)11-9(13)8(6)12/h2-3H,1H3,(H,11,12,13)
5. Std. InChIKey: VYPAAYCDBZXFOI-UHFFFAOYSA-N

Product Name

4-BROMO-7-METHYLISATIN

1H-Indole-2,3-dione,4-bromo-7-methyl- Specification

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