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5-BROMO-2-METHOXYCYCLOHEPTA-2,4,6-TRIEN-1-ONE

5-BROMO-2-METHOXYCYCLOHEPTA-2,4,6-TRIEN-1-ONE structure

CAS No:
33816-51-2
Formula:
C8H7BrO2
Chemical Name:
5-BROMO-2-METHOXYCYCLOHEPTA-2,4,6-TRIEN-1-ONE
Synonyms:
5-Bromo-2-methoxycyclohepta-2,4,6-trien-1-one;5-bromo-2-methoxy-cyclohepta-2,4,6-trien-1-one;2-Methoxy-5-bromotropone;5-Bromo-2-methoxy-2,4,6-cycloheptatrien-1-one;SCHEMBL8591775;CTK4H1278;DTXSID70345374;MFCD08166336;ZINC26896130;SC-54031

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5-BROMO-2-METHOXYCYCLOHEPTA-2,4,6-TRIEN-1-ONE Basic Attributes

Molecular Weight：

215.04

Exact Mass：

213.96300

DSSTox ID：

DTXSID70345374

HScode：

2914700090

Characteristics

PSA：

26.3

XLogP3：

1.81790

Density：

1.54±0.1 g/cm3(Predicted)

Melting Point：

138-139 °C

Computed Properties

Molecular Weight:215.04
XLogP3:2.2
Hydrogen Bond Acceptor Count:2
Rotatable Bond Count:1
Exact Mass:213.96294
Monoisotopic Mass:213.96294
Topological Polar Surface Area:26.3
Heavy Atom Count:11
Complexity:261
Covalently-Bonded Unit Count:1
Compound Is Canonicalized:Yes

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Guide of 5-BROMO-2-METHOXYCYCLOHEPTA-2,4,6-TRIEN-1-ONE

Basic Attributes
Characteristics
Computed Properties

5-BROMO-2-METHOXYCYCLOHEPTA-2,4,6-TRIEN-1-ONE

SDS

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