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Basic Information
CAS No.: 7147-90-2
Name: 4-Chlorophthalimide
Molecular Structure:
Molecular Structure of 7147-90-2 (4-Chlorophthalimide)
Formula: C8H4ClNO2
Molecular Weight: 181.578
Synonyms: 5-chloroisoindole-1,3-dione;
EINECS: 1312995-182-4
Density: 1.519 g/cm3
Melting Point: 210 °C
Appearance: slight yellow crystalline powder
PSA: 46.17000
LogP: 1.55240
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    4-Chlorophthalimide

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  • 5-Chloroisoindoline-1,3-dione

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    5-Chloroisoindoline-1,3-dione

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Chemistry

Molecule structure of 4-Chlorophthalimide (CAS NO.7147-90-2):

IUPAC Name: 5-Chloroisoindole-1,3-dione 
Molecular Weight: 181.57586 g/mol
Molecular Formula: C8H4ClNO2 
Density: 1.519 g/cm3
Index of Refraction: 1.626
Molar Refractivity: 42.31 cm3
Molar Volume: 119.5 cm3
Polarizability: 16.77×10-24 cm3
Surface Tension: 56.8 dyne/cm
XLogP3: 1.8
H-Bond Donor: 1
H-Bond Acceptor: 2
Tautomer Count: 3
Exact Mass: 180.993056
MonoIsotopic Mass: 180.993056
Topological Polar Surface Area: 46.2
Heavy Atom Count: 12
Canonical SMILES: C1=CC2=C(C=C1Cl)C(=O)NC2=O
InChI: InChI=1S/C8H4ClNO2/c9-4-1-2-5-6(3-4)8(12)10-7(5)11/h1-3H,(H,10,11,12)
InChIKey: BGJNRQSGJHVURK-UHFFFAOYSA-N

Specification

 4-Chlorophthalimide (CAS NO.7147-90-2) is also named as 1H-isoindole-1,3(2H)-dione, 5-chloro- ; 5-Chloro-1H-isoindole-1,3(2H)-dione . 4-Chlorophthalimide (CAS NO.7147-90-2) is slight yellow crystalline powder.