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2-(3-Mercaptopropyl)-1H-isoindole-1,3(2H)-dione

2-(3-Mercaptopropyl)-1H-isoindole-1,3(2H)-dione structure

CAS No:
39801-32-6
Formula:
C11H11NO2S
Chemical Name:
2-(3-Mercaptopropyl)-1H-isoindole-1,3(2H)-dione
Synonyms:
1H-Isoindole-1,3(2H)-dione,2-(3-mercaptopropyl)-;2-(3-Mercaptopropyl)-1H-isoindole-1,3(2H)-dione;N-(3-Mercaptopropyl)phthalimide;3-Mercaptopropylphthalimide;3-Phthalimidopropylthiol;2-(3-Sulfanylpropyl)-2,3-dihydro-1H-isoindole-1,3-dione

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2-(3-Mercaptopropyl)-1H-isoindole-1,3(2H)-dione Basic Attributes

Molecular Weight：

221.27600

Exact Mass：

221.28

DSSTox ID：

DTXSID80192876

Characteristics

PSA：

62.68000

XLogP3：

2.27870

Density：

1.31g/cm3

Melting Point：

47-48 °C @ Solvent: Diethyl ether, Hexane

Boiling Point：

366.3ºC

Flash Point：

175.3ºC

Refractive Index：

1.633

Computed Properties

Molecular Weight:221.28
XLogP3:1.8
Hydrogen Bond Acceptor Count:3
Rotatable Bond Count:3
Exact Mass:221.05104977
Monoisotopic Mass:221.05104977
Topological Polar Surface Area:62.7
Heavy Atom Count:15
Complexity:256
Covalently-Bonded Unit Count:1
Compound Is Canonicalized:Yes

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Guide of 2-(3-Mercaptopropyl)-1H-isoindole-1,3(2H)-dione

Basic Attributes
Characteristics
Computed Properties

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