5-Amino-6-chloroisoindoline-1,3-dione supplier

Name
5-Amino-6-chloroisoindoline-1,3-dione
EINECS
CAS No. 5566-48-3
Article Data3
CAS DataBase
Density 1.614 g/cm³
Solubility
Melting Point
Formula C₈H₅ClN₂O₂
Boiling Point
Molecular Weight 196.5905
Flash Point
Transport Information
Appearance
Safety
Risk Codes
Molecular Structure
Hazard Symbols
Synonyms 5-Amino-6-chloro-1H-isoindole-1,3(2H)-dione;
PSA 72.19000
LogP 1.71580

5-Amino-6-chloroisoindoline-1,3-dione Specification

The 5-Amino-6-chloroisoindoline-1,3-dione, with the CAS registry number 5566-48-3, is also known as 5-Amino-6-chloro-isoindole-1,3-dione. This chemical's molecular formula is C₈H₅ClN₂O₂ and molecular weight is 196.5905. What's more, its systematic name is 5-Amino-6-chloro-1H-isoindole-1,3(2H)-dione.

Physical properties about the 5-Amino-6-chloroisoindoline-1,3-dione are: (1) ACD/LogP: 0.84; (2) # of Rule of 5 Violations: 0; (3) ACD/LogD (pH 5.5): 0.84; (4) ACD/LogD (pH 7.4): 0.83; (5) ACD/BCF (pH 5.5): 2.57; (6) ACD/BCF (pH 7.4): 2.48; (7) ACD/KOC (pH 5.5): 68.3; (8) ACD/KOC (pH 7.4): 65.92; (9) #H bond acceptors: 4; (10) #H bond donors: 3; (11) #Freely Rotating Bonds: 1; (12) Polar Surface Area: 40.62 Å²; (13) Index of Refraction: 1.69; (14) Molar Refractivity: 46.55 cm³; (15) Molar Volume: 121.7 cm³; (16) Polarizability: 18.45×10^-24cm³; (17) Surface Tension: 73.1 dyne/cm; (18) Density: 1.614 g/cm³.

You can still convert the following datas into molecular structure:
(1) SMILES: Clc1c(cc2C(=O)NC(=O)c2c1)N
(2) InChI: InChI=1/C8H5ClN2O2/c9-5-1-3-4(2-6(5)10)8(13)11-7(3)12/h1-2H,10H2,(H,11,12,13)
(3) InChIKey: IQKKTRRHCGJXKQ-UHFFFAOYAD

Product Name

5-Amino-6-chloroisoindoline-1,3-dione

5-Amino-6-chloroisoindoline-1,3-dione Specification

Related Products

Hot Products