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7-bromothiochroman-4-ol

7-bromothiochroman-4-ol structure

CAS No:
13735-27-8
Formula:
C9H9BrOS
Chemical Name:
7-bromothiochroman-4-ol
Synonyms:
7-bromothiochroman-4-ol;2H-1-Benzothiopyran-4-ol, 7-bromo-3,4-dihydro-

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7-bromothiochroman-4-ol Basic Attributes

Molecular Weight：

245.14

Exact Mass：

243.956

Characteristics

PSA：

45.53

XLogP3：

2.9783

Density：

1.646±0.06 g/cm3

Melting Point：

111-112 °C

Boiling Point：

334.3±42.0 °C(Predicted)

PKA：

13.58±0.20

Computed Properties

Molecular Weight:245.14
XLogP3:2.4
Hydrogen Bond Donor Count:1
Hydrogen Bond Acceptor Count:2
Exact Mass:243.95575
Monoisotopic Mass:243.95575
Topological Polar Surface Area:45.5
Heavy Atom Count:12
Complexity:165
Undefined Atom Stereocenter Count:1
Covalently-Bonded Unit Count:1
Compound Is Canonicalized:Yes

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Guide of 7-bromothiochroman-4-ol

Basic Attributes
Characteristics
Computed Properties

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