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1-bromo-3-(cyclopropylmethoxy)-5-(trifluoromethyl)benzene

1-bromo-3-(cyclopropylmethoxy)-5-(trifluoromethyl)benzene

CAS: 1369928-61-9

Formula: C11H10BrF3O

SMILES: FC(F)(F)C1=CC(Br)=CC(OCC2CC2)=C1

IUPAC: 1-bromo-3-(cyclopropylmethoxy)-5-(trifluoromethyl)benzene

InChI: InChI=1S/C11H10BrF3O/c12-9-3-8(11(13,14)15)4-10(5-9)16-6-7-1-2-7/h3-5,7H,1-2,6H2

Composition: C (44.77%), H (3.42%), Br (27.08%), F (19.31%), O (5.42%)

Molar Mass: 295.099

Atom Count: 26

Heavy Atom Count: 16

Properties
Properties
Common Names N/A
Aromatic Ring Count 1
Asymmetric Atom Count 0
Exact Mass 293.986712
Formal Charge 0
FSP3 0.45
Hetero Ring Count 0
Hydrogen Bond Acceptor Count 1
Hydrogen Bond Donor Count 0
InChIKey XECQVMRJFMJUQS-UHFFFAOYSA-N
Lipinski's Rule of Five 1
Molar Refractivity 58.06
Topological Polar Surface Area 9.23
Polarizability 21.84
Ring Count 2
Rotatable Bond Count 4

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Purity LeadTime CAS PacketSize UnitPrice
95% <5 Days 1369928-61-9 $196.72-$960.88$196.72$336.69$960.88
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