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

1(3H)-Isobenzofuranone, 3-(1H-indol-3-yl)-

Related Products

Hot Products

Name

1(3H)-Isobenzofuranone, 3-(1H-indol-3-yl)-

EINECS N/A
CAS No. 6936-87-4 Density 1.364 g/cm3
PSA 42.09000 LogP 3.42770
Solubility N/A Melting Point N/A
Formula C16H11NO2 Boiling Point 492.3 °C at 760 mmHg
Molecular Weight 249.26 Flash Point 251.5 °C
Transport Information N/A Appearance N/A
Safety Risk Codes N/A
Molecular Structure Molecular Structure of 6936-87-4 (3-(1H-indol-3-yl)-3H-isobenzofuran-1-one) Hazard Symbols N/A
Synonyms

Phthalide, 3-indol-3-yl- (6CI,8CI);NSC 42087;3-(1H-Indol-3-yl)-2-benzofuran-1(3H)-one;

Article Data 7

1(3H)-Isobenzofuranone, 3-(1H-indol-3-yl)- Specification

The 1(3H)-Isobenzofuranone, 3-(1H-indol-3-yl)-, with the CAS registry number 6936-87-4, is also known as Phthalide, 3-indol-3-yl- (6CI,8CI). This chemical's molecular formula is C16H11NO2 and molecular weight is 249.26. What's more, its systematic name is 3-(1H-indol-3-yl)-2-benzofuran-1(3H)-one. 

Physical properties of 1(3H)-Isobenzofuranone, 3-(1H-indol-3-yl)- are: (1)ACD/LogP: 2.51; (2)# of Rule of 5 Violations: 0; (3)#H bond acceptors: 3; (4)#H bond donors: 1; (5)#Freely Rotating Bonds: 1; (6)Polar Surface Area: 31.23 Å2; (7)Index of Refraction: 1.721; (8)Molar Refractivity: 72.27 cm3; (9)Molar Volume: 182.6 cm3; (10)Polarizability: 28.65×10-24cm3; (11)Surface Tension: 63.6 dyne/cm; (12)Density: 1.364 g/cm3; (13)Flash Point: 251.5 °C; (14)Enthalpy of Vaporization: 75.92 kJ/mol; (15)Boiling Point: 492.3 °C at 760 mmHg; (16)Vapour Pressure: 7.76E-10 mmHg at 25°C.

You can still convert the following datas into molecular structure:
(1)SMILES: O=C2OC(c1ccccc12)c4c3ccccc3nc4
(2)InChI: InChI=1S/C16H11NO2/c18-16-12-7-2-1-6-11(12)15(19-16)13-9-17-14-8-4-3-5-10(13)14/h1-9,15,17H
(3)InChIKey: NFKMAYYHLXEVDM-UHFFFAOYSA-N

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 6936-87-4