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6,7-dimethoxy-4-(4-chlorobenzyl)isoquinoline

6,7-dimethoxy-4-(4-chlorobenzyl)isoquinoline structure

CAS No:
32871-99-1
Formula:
C18H16ClNO2
Chemical Name:
6,7-dimethoxy-4-(4-chlorobenzyl)isoquinoline
Synonyms:
6,7-dimethoxy-4-(4-chlorobenzyl)isoquinoline;Isoquinoline, 4-[(4-chlorophenyl)methyl]-6,7-dimethoxy-

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6,7-dimethoxy-4-(4-chlorobenzyl)isoquinoline Basic Attributes

Molecular Weight：

313.78

Exact Mass：

313.0869564 g/mol

DSSTox ID：

DTXSID40186534

Characteristics

PSA：

31.4 Å²

Density：

1.225±0.06 g/cm3

Melting Point：

156-157 °C(Solv: methanol (67-56-1); ethyl ether (60-29-7))

Boiling Point：

466.9±40.0 °C(Predicted)

PKA：

6.25±0.11

Drug Information

MeSH Entry Terms：

6,7-dimethoxy-4-(4-chlorobenzyl)isoquinoline

Computed Properties

Molecular Weight:313.8
XLogP3:4.6
Hydrogen Bond Acceptor Count:3
Rotatable Bond Count:4
Exact Mass:313.0869564
Monoisotopic Mass:313.0869564
Topological Polar Surface Area:31.4
Heavy Atom Count:22
Complexity:346
Covalently-Bonded Unit Count:1
Compound Is Canonicalized:Yes

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Guide of 6,7-dimethoxy-4-(4-chlorobenzyl)isoquinoline

Basic Attributes
Characteristics
Drug Information
Computed Properties

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