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4-TRIFLUOROMETHYL-6,7DIHYDRO-5H-CYCLOPENTA-PYRIMIDINE-2-THIOL

4-TRIFLUOROMETHYL-6,7DIHYDRO-5H-CYCLOPENTA-PYRIMIDINE-2-THIOL structure

CAS No:
318258-17-2
Formula:
C8H7F3N2S
Chemical Name:
4-TRIFLUOROMETHYL-6,7DIHYDRO-5H-CYCLOPENTA-PYRIMIDINE-2-THIOL
Synonyms:
6,7-DIHYDRO-2-MERCAPTO-4-TRIFLUOROMETHYL-5H-CYCLOPENTA-[B]-PYRIMIDINE;4-TRIFLUOROMETHYL-6,7DIHYDRO-5H-CYCLOPENTA-PYRIMIDINE-2-THIOL;2H-Cyclopentapyrimidine-2-thione, 1,5,6,7-tetrahydro-4-(trifluoromethyl)- (9CI)

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4-TRIFLUOROMETHYL-6,7DIHYDRO-5H-CYCLOPENTA-PYRIMIDINE-2-THIOL Basic Attributes

Molecular Weight：

220.21

Exact Mass：

220.02820389

Characteristics

Density：

1.61±0.1 g/cm3

Melting Point：

138-140 °C(Solv: ethanol (64-17-5))

Boiling Point：

231.3±50.0 °C(Predicted)

PKA：

10.31±0.40

Computed Properties

Molecular Weight:220.22
XLogP3:2
Hydrogen Bond Donor Count:1
Hydrogen Bond Acceptor Count:4
Exact Mass:220.02820389
Monoisotopic Mass:220.02820389
Topological Polar Surface Area:56.5
Heavy Atom Count:14
Complexity:354
Covalently-Bonded Unit Count:1
Compound Is Canonicalized:Yes

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Guide of 4-TRIFLUOROMETHYL-6,7DIHYDRO-5H-CYCLOPENTA-PYRIMIDINE-2-THIOL

Basic Attributes
Characteristics
Computed Properties

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