4-Amino-1-isoindolinone supplier

Name
4-AMINOISOINDOLIN-1-ONE
EINECS
CAS No. 366452-98-4
Article Data10
CAS DataBase
Density 1.307 g/cm³
Solubility
Melting Point 225-230 °C
Formula C₈H₈N₂O
Boiling Point 489.776 °C at 760 mmHg
Molecular Weight 148.164
Flash Point 250.008 °C
Transport Information
Appearance
Safety
Risk Codes
Molecular Structure
Hazard Symbols
Synonyms 4-Amino-2,3-dihydroisoindol-1-one;
PSA 55.12000
LogP 1.42220

4-Amino-1-isoindolinone Specification

The 1H-Isoindol-1-one,4-amino-2,3-dihydro- is an organic compound with the formula C₈H₈N₂O. The systematic name of this chemical is 4-amino-2,3-dihydro-1H-isoindol-1-one. With the CAS registry number 366452-98-4, it is also named as 4-amino-1-isoindolinone. The product's category is Alcohol; Amineprimary.

Physical properties about 1H-Isoindol-1-one,4-amino-2,3-dihydro- are: (1)ACD/LogP: -0.75; (2)ACD/LogD (pH 5.5): -1; (3)ACD/LogD (pH 7.4): -1; (4)ACD/BCF (pH 5.5): 1; (5)ACD/BCF (pH 7.4): 1; (6)ACD/KOC (pH 5.5): 7; (7)ACD/KOC (pH 7.4): 7; (8)#H bond acceptors: 3; (9)#H bond donors: 3; (10)#Freely Rotating Bonds: 1; (11)Polar Surface Area: 55.12 Å²; (12)Index of Refraction: 1.654; (13)Molar Refractivity: 41.53 cm³; (14)Molar Volume: 113.335 cm³; (15)Polarizability: 16.464×10^-24cm³; (16)Surface Tension: 58.788 dyne/cm; (17)Density: 1.307 g/cm³; (18)Flash Point: 250.008 °C; (19)Enthalpy of Vaporization: 75.616 kJ/mol; (20)Boiling Point: 489.776 °C at 760 mmHg.

You can still convert the following datas into molecular structure:
(1)SMILES: O=C2c1cccc(c1CN2)N
(2)InChI: InChI=1/C8H8N2O/c9-7-3-1-2-5-6(7)4-10-8(5)11/h1-3H,4,9H2,(H,10,11)
(3)InChIKey: GZRGLZWHIFBBLS-UHFFFAOYAM
(4)Std. InChI: InChI=1S/C8H8N2O/c9-7-3-1-2-5-6(7)4-10-8(5)11/h1-3H,4,9H2,(H,10,11)
(5)Std. InChIKey: GZRGLZWHIFBBLS-UHFFFAOYSA-N

Product Name

4-AMINOISOINDOLIN-1-ONE

4-Amino-1-isoindolinone Specification

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