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7-(trifluoromethyl)-3,4-dihydro-2H-1,4-benzoxazine

7-(trifluoromethyl)-3,4-dihydro-2H-1,4-benzoxazine

CAS: 347-41-1

Formula: C9H8F3NO

SMILES: FC(F)(F)C1=CC2=C(NCCO2)C=C1

IUPAC: 7-(trifluoromethyl)-3,4-dihydro-2H-1,4-benzoxazine

InChI: InChI=1S/C9H8F3NO/c10-9(11,12)6-1-2-7-8(5-6)14-4-3-13-7/h1-2,5,13H,3-4H2

Composition: C (53.21%), H (3.97%), F (28.05%), N (6.89%), O (7.87%)

Molar Mass: 203.164

Atom Count: 22

Heavy Atom Count: 14

Properties
Properties
Common Names N/A
Aromatic Ring Count 1
Asymmetric Atom Count 0
Exact Mass 203.055798371
Formal Charge 0
FSP3 0.33
Hetero Ring Count 1
Hydrogen Bond Acceptor Count 2
Hydrogen Bond Donor Count 1
InChIKey YEPAXHCFTVUJLJ-UHFFFAOYSA-N
Lipinski's Rule of Five 1
Molar Refractivity 46.72
Topological Polar Surface Area 21.26
Polarizability 16.33
Ring Count 2
Rotatable Bond Count 1

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Struchem co.,ltd
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95% <5 Days 347-41-1 $683.00$683.00
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Chemcia Scientific, LLC
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95% <2 Days 347-41-1 $517.50-$2,064.25$517.50$736.00$1,437.50$2,064.25
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