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(7aS)-6,7,7a,8-Tetrahydro-4,11-dimethoxy-5H-benzo[g]-1,3-benzodioxolo[6,5,4-de]quinolin-10-ol

(7aS)-6,7,7a,8-Tetrahydro-4,11-dimethoxy-5H-benzo[g]-1,3-benzodioxolo[6,5,4-de]quinolin-10-ol structure

CAS No:
4030-51-7
Formula:
C19H19NO5
Chemical Name:
(7aS)-6,7,7a,8-Tetrahydro-4,11-dimethoxy-5H-benzo[g]-1,3-benzodioxolo[6,5,4-de]quinolin-10-ol
Synonyms:
5H-Benzo[g]-1,3-benzodioxolo[6,5,4-de]quinolin-10-ol,6,7,7a,8-tetrahydro-4,11-dimethoxy-,(7aS)-;6aα-Noraporphin-9-ol,3,10-dimethoxy-1,2-(methylenedioxy)-;Cassyfiline;5H-Benzo[g]-1,3-benzodioxolo[6,5,4-de]quinolin-10-ol,6,7,7a,8-tetrahydro-4,11-dimethoxy-,(S)-;(7aS)-6,7,7a,8-Tetrahydro-4,11-dimethoxy-5H-benzo[g]-1,3-benzodioxolo[6,5,4-de]quinolin-10-ol;Cassythine
Categories:
Natural Products > Alkaloids

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Description

Cassyfiline is an aporphine alkaloid.

(7aS)-6,7,7a,8-Tetrahydro-4,11-dimethoxy-5H-benzo[g]-1,3-benzodioxolo[6,5,4-de]quinolin-10-ol Basic Attributes

Molecular Weight：

341.35786

Exact Mass：

341.36

DSSTox ID：

DTXSID00331765

Characteristics

PSA：

69.2

XLogP3：

2.49

Density：

1.4±0.1 g/cm3

Melting Point：

217 °C (decomp)

Boiling Point：

552.2±50.0 °C at 760 mmHg

Flash Point：

287.8±30.1 °C

Refractive Index：

1.640

Computed Properties

Molecular Weight:341.4
XLogP3:2.4
Hydrogen Bond Donor Count:2
Hydrogen Bond Acceptor Count:6
Rotatable Bond Count:2
Exact Mass:341.12632271
Monoisotopic Mass:341.12632271
Topological Polar Surface Area:69.2
Heavy Atom Count:25
Complexity:504
Defined Atom Stereocenter Count:1
Covalently-Bonded Unit Count:1
Compound Is Canonicalized:Yes

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Guide of (7aS)-6,7,7a,8-Tetrahydro-4,11-dimethoxy-5H-benzo[g]-1,3-benzodioxolo[6,5,4-de]quinolin-10-ol

Description
Basic Attributes
Characteristics
Computed Properties
Learn More Other Chemicals

(7aS)-6,7,7a,8-Tetrahydro-4,11-dimethoxy-5H-benzo[g]-1,3-benzodioxolo[6,5,4-de]quinolin-10-ol

SDS

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