1H-Indole-2,3-dione,1-(phenylmethyl)- supplier

Name
1-BENZYL-1H-INDOLE-2,3-DIONE
EINECS
CAS No. 1217-89-6
Article Data202
CAS DataBase
Density 1.311 g/cm³
Solubility
Melting Point 128.0 to 132.0 °C
Formula C₁₅H₁₁NO₂
Boiling Point 416.8 °C at 760 mmHg
Molecular Weight 237.258
Flash Point 195.9 °C
Transport Information
Appearance
Safety
Risk Codes
Molecular Structure
Hazard Symbols
Synonyms Isatin, 1-benzyl- (6CI);1-(Phenylmethyl)-1H-indole-2,3-dione;1-Benzyl-1H-indole-2,3-dione;1-Benzylindoline-2,3-dione;1-Benzylisatin;N-Benzylisatin;NSC 100000;Indole-2,3-dione,1-benzyl- (7CI,8CI);
PSA 37.38000
LogP 2.48110

1H-Indole-2,3-dione,1-(phenylmethyl)- Specification

The 1H-Indole-2,3-dione,1-(phenylmethyl)-, with the CAS registry number 1217-89-6, is also known as N-Benzylisatin. This chemical's molecular formula is C₁₅H₁₁NO₂ and molecular weight is 237.2533. Its IUPAC name is called 1-benzylindole-2,3-dione.

Physical properties of 1H-Indole-2,3-dione,1-(phenylmethyl)-: (1)ACD/LogP: 2.36; (2)#H bond acceptors: 3; (3)#Freely Rotating Bonds: 2; (4)Index of Refraction: 1.66; (5)Molar Refractivity: 66.8 cm³; (6)Molar Volume: 180.8 cm³; (7)Surface Tension: 59.8 dyne/cm; (8)Density: 1.311 g/cm³; (9)Flash Point: 195.9 °C; (10)Enthalpy of Vaporization: 67.01 kJ/mol; (11)Boiling Point: 416.8 °C at 760 mmHg; (12)Vapour Pressure: 3.72E-07 mmHg at 25°C.

You can still convert the following datas into molecular structure:
(1)Canonical SMILES: C1=CC=C(C=C1)CN2C3=CC=CC=C3C(=O)C2=O
(2)InChI: InChI=1S/C15H11NO2/c17-14-12-8-4-5-9-13(12)16(15(14)18)10-11-6-2-1-3-7-11/h1-9H,10H2
(3)InChIKey: SIISFRLGYDVIRG-UHFFFAOYSA-N

Product Name

1-BENZYL-1H-INDOLE-2,3-DIONE

1H-Indole-2,3-dione,1-(phenylmethyl)- Specification

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