Isoindoline hydrochloride supplier

Name
2,3-Dihydroisoindole hydrochloride
EINECS
CAS No. 32372-82-0
Article Data7
CAS DataBase
Density
Solubility Soluble in water.
Melting Point 255-256℃
Formula C₈H₁₀ClN
Boiling Point 239.8 °C at 760 mmHg
Molecular Weight 155.627
Flash Point 98.8 °C
Transport Information
Appearance
Safety
Risk Codes
Molecular Structure
Hazard Symbols
Synonyms 1H-Isoindole,2,3-dihydro-, hydrochloride (9CI);Isoindoline, hydrochloride (8CI);2,3-Dihydro-1H-isoindol hydrochloride;2,3-Dihydroisoindole hydrochloride;
PSA 12.36000
LogP 1.85670

Isoindoline hydrochloride Specification

The IUPAC name of Isoindoline hydrochloride is 2,3-dihydro-1H-isoindole hydrochloride. With the CAS registry number 32372-82-0, it is also named as 2,3-Dihydroisoindole hydrochloride. The product's category is Pharmaceutical Intermediates. In addition, its molecular formula is C₈H₁₀ClN and molecular weight is 155.62.

The other characteristics of Isoindoline hydrochloride can be summarized as: (1)ACD/LogP: 1.01; (2)# of Rule of 5 Violations: 0; (3)ACD/BCF (pH 5.5): 1; (4)ACD/BCF (pH 7.4): 1; (5)ACD/KOC (pH 5.5): 1; (6)ACD/KOC (pH 7.4): 1.21; (7)H-Bond Donor: 2; (8)H-Bond Acceptor: 1; (9)Rotatable Bond Count: 0; (10)Exact Mass: 155.050177; (11)MonoIsotopic Mass: 155.050177; (12)Topological Polar Surface Area: 12; (13)Heavy Atom Count: 10; (14)Complexity: 88.7; (15)Freely Rotating Bonds: 0; (16)Flash Point: 98.8 °C; (17)Enthalpy of Vaporization: 48.63 kJ/mol; (18)Boiling Point: 239.8 °C at 760 mmHg; (19)Vapour Pressure: 0.0317 mmHg at 25 °C.

People can use the following data to convert to the molecule structure.
(1)SMILES:Cl.c1cccc2CNCc12
(2)InChI:InChI=1/C8H9N.ClH/c1-2-4-8-6-9-5-7(8)3-1;/h1-4,9H,5-6H2;1H
(3)InChIKey:NOVIRODZMIZUPA-UHFFFAOYAY
(4)Std. InChI:InChI=1S/C8H9N.ClH/c1-2-4-8-6-9-5-7(8)3-1;/h1-4,9H,5-6H2;1H
(5)Std. InChIKey:NOVIRODZMIZUPA-UHFFFAOYSA-N

Product Name

2,3-Dihydroisoindole hydrochloride

Isoindoline hydrochloride Specification

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