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1H-Indole, 5-chloro-1-(4-piperidinyl)- structure

1H-Indole, 5-chloro-1-(4-piperidinyl)- structure

1H-Indole, 5-chloro-1-(4-piperidinyl)-

CAS No.: 1996-90-3

Molecular Weight：330.69

Modify Date.: 2022-02-13 03:57

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1. Names and Identifiers

1.1 Name: 1H-Indole, 5-chloro-1-(4-piperidinyl)-

2. Properties

3.1 Density: 1.3±0.1 g/cm3 (Predicted)

3.1 Flash Point: 268.4±30.1 °C (Predicted)

3. Computational chemical data

Molecular Weight: 330.69g/mol
Molecular Formula: C_₁₉H_₃₁IN_₄O_₂
Compound Is Canonicalized: True
XLogP3-AA: 3.7
Exact Mass: 330.0382897
Monoisotopic Mass: 330.0382897
Complexity: 395
Rotatable Bond Count: 2
Hydrogen Bond Donor Count: 2
Hydrogen Bond Acceptor Count: 5
Topological Polar Surface Area: 52.6
Heavy Atom Count: 22
Defined Atom Stereocenter Count: 0
Undefined Atom Stereocenter Count: 0
Defined Bond Stereocenter Count: 0
Undefined Bond Stereocenter Count: 0
Isotope Atom Count: 0
Covalently-Bonded Unit Count: 1

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Directory

1. Names and Identifiers

1.4 Molecular Formula

1.7 Canonical Smiles

1.8 Isomers Smiles

2. Properties

3.1 Flash Point

3.Computational chemical data

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