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5-bromo-1,3-difluoro-2-propoxybenzene

5-bromo-1,3-difluoro-2-propoxybenzene

Formula: C9H9BrF2O

SMILES: CCCOC1=C(F)C=C(Br)C=C1F

IUPAC: 5-bromo-1,3-difluoro-2-propoxybenzene

InChI: InChI=1S/C9H9BrF2O/c1-2-3-13-9-7(11)4-6(10)5-8(9)12/h4-5H,2-3H2,1H3

Composition: C (43.06%), H (3.61%), Br (31.83%), F (15.13%), O (6.37%)

Molar Mass: 251.071

Atom Count: 22

Heavy Atom Count: 13

Properties
Properties
Common Names N/A
Aromatic Ring Count 1
Asymmetric Atom Count 0
Exact Mass 249.980484
Formal Charge 0
FSP3 0.33
Hetero Ring Count 0
Hydrogen Bond Acceptor Count 1
Hydrogen Bond Donor Count 0
InChIKey NKSUOXIHAGRDGG-UHFFFAOYSA-N
Lipinski's Rule of Five 1
Molar Refractivity 49.85
Topological Polar Surface Area 9.23
Polarizability 18.97
Ring Count 1
Rotatable Bond Count 3

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Purity LeadTime Formula UnitPrice
98% <10 Days C9H9BrF2O Quote Only