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5-[2-(1,3-benzodioxol-5-yl)ethyl]-7-methyl-[1,3]dioxolo[4,5-g]isoquinoline

5-[2-(1,3-benzodioxol-5-yl)ethyl]-7-methyl-[1,3]dioxolo[4,5-g]isoquinoline structure

CAS No:
20226-11-3
Formula:
C20H17NO4
Chemical Name:
5-[2-(1,3-benzodioxol-5-yl)ethyl]-7-methyl-[1,3]dioxolo[4,5-g]isoquinoline

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5-[2-(1,3-benzodioxol-5-yl)ethyl]-7-methyl-[1,3]dioxolo[4,5-g]isoquinoline Basic Attributes

Molecular Weight：

335.35300

Exact Mass：

335.11575802 g/mol

DSSTox ID：

DTXSID00174073

Characteristics

PSA：

49.81000

XLogP3：

3.78580

Density：

1.347g/cm3

Boiling Point：

484ºC

Flash Point：

172.4ºC

Refractive Index：

1.673

Vapor Pressure：

4.69E-09mmHg at 25°C

Computed Properties

Molecular Weight:335.4
XLogP3:4.4
Hydrogen Bond Acceptor Count:5
Rotatable Bond Count:3
Exact Mass:335.11575802
Monoisotopic Mass:335.11575802
Topological Polar Surface Area:49.8
Heavy Atom Count:25
Complexity:475
Covalently-Bonded Unit Count:1
Compound Is Canonicalized:Yes

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Guide of 5-[2-(1,3-benzodioxol-5-yl)ethyl]-7-methyl-[1,3]dioxolo[4,5-g]isoquinoline

Basic Attributes
Characteristics
Computed Properties

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