tert-butyl(3-((2-chloro-5-(trifluoroMethyl)pyriMidin-4-yl)aMino)phenyl)carbaMate
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tert-butyl(3-((2-chloro-5-(trifluoroMethyl)pyriMidin-4-yl)aMino)phenyl)carbaMate
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CAS No:
1374507-23-9
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Formula:
C16H16ClF3N4O2
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Chemical Name:
tert-butyl(3-((2-chloro-5-(trifluoroMethyl)pyriMidin-4-yl)aMino)phenyl)carbaMate
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Synonyms:
tert-butyl (3-((2-chloro-5-(trifluoroMethyl)pyriMidin-4-yl)aMino)phenyl)carbaMate;tert-butyl N-(3-{[2-chloro-5-(trifluoromethyl)pyrimidin-4-yl]amino}phenyl)carbamate;N-[3-[[2-Chloro-5-(trifluoromethyl)-4-pyrimidinyl]amino]phenyl]carbamic acid 1,1-dimethylethyl ester;CO-1686 intermediate 3;ROCI-003;CO1686 Intermediate2;Carbamic acid, N-[3-[[2-chloro-5-(trifluoromethyl)-4-pyrimidinyl]amino]phenyl]-, 1,1-dimethylethyl ester
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CAS No:
tert-butyl(3-((2-chloro-5-(trifluoroMethyl)pyriMidin-4-yl)aMino)phenyl)carbaMate Basic Attributes
388.77
388.0913879
1592732-453-0
Characteristics
76.14000
5.38540
1.406±0.06 g/cm3
446.2±45.0 °C(Predicted)
Sparingly Soluble (5.4E-3 g/L) (25 ºC), Calc.
13.43±0.70
Computed Properties
Molecular Weight:388.77
XLogP3:4.5
Hydrogen Bond Donor Count:2
Hydrogen Bond Acceptor Count:8
Rotatable Bond Count:5
Exact Mass:388.0913879
Monoisotopic Mass:388.0913879
Topological Polar Surface Area:76.1
Heavy Atom Count:26
Complexity:487
Covalently-Bonded Unit Count:1
Compound Is Canonicalized:Yes
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