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2-CHLORO-1-[1-(TRIFLUOROMETHYL)-1,3,4,9-TETRAHYDRO-2H-BETA-CARBOLIN-2-YL]ETHAN-1-ONE

2-CHLORO-1-[1-(TRIFLUOROMETHYL)-1,3,4,9-TETRAHYDRO-2H-BETA-CARBOLIN-2-YL]ETHAN-1-ONE structure

CAS No:
257295-47-9
Formula:
C14H12ClF3N2O
Chemical Name:
2-CHLORO-1-[1-(TRIFLUOROMETHYL)-1,3,4,9-TETRAHYDRO-2H-BETA-CARBOLIN-2-YL]ETHAN-1-ONE
Synonyms:
2-CHLORO-1-[1-(TRIFLUOROMETHYL)-1,3,4,9-TETRAHYDRO-2H-BETA-CARBOLIN-2-YL]ETHAN-1-ONE;2-Chloro-1-[1-(trifluoromethyl)-1,3,4,9-tetrahydro-2H-β-carbolin-2-yl]ethan-1-one

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2-CHLORO-1-[1-(TRIFLUOROMETHYL)-1,3,4,9-TETRAHYDRO-2H-BETA-CARBOLIN-2-YL]ETHAN-1-ONE Basic Attributes

Molecular Weight：

316.71

Exact Mass：

316.05900

DSSTox ID：

DTXSID30347435

Characteristics

PSA：

36.1

XLogP3：

3.33270

Density：

1.469g/cm3

Melting Point：

232.5 °C

Boiling Point：

468.1ºC at 760 mmHg

Flash Point：

236.9ºC

Refractive Index：

1.593

Computed Properties

Molecular Weight:316.70
XLogP3:3.2
Hydrogen Bond Donor Count:1
Hydrogen Bond Acceptor Count:4
Rotatable Bond Count:1
Exact Mass:316.0590252
Monoisotopic Mass:316.0590252
Topological Polar Surface Area:36.1
Heavy Atom Count:21
Complexity:418
Undefined Atom Stereocenter Count:1
Covalently-Bonded Unit Count:1
Compound Is Canonicalized:Yes

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Guide of 2-CHLORO-1-[1-(TRIFLUOROMETHYL)-1,3,4,9-TETRAHYDRO-2H-BETA-CARBOLIN-2-YL]ETHAN-1-ONE

Basic Attributes
Characteristics
Computed Properties

2-CHLORO-1-[1-(TRIFLUOROMETHYL)-1,3,4,9-TETRAHYDRO-2H-BETA-CARBOLIN-2-YL]ETHAN-1-ONE

SDS

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