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1-(4-bromo-3-fluorophenyl)butan-1-one

1-(4-bromo-3-fluorophenyl)butan-1-one

Formula: C10H10BrFO

SMILES: CCCC(=O)C1=CC(F)=C(Br)C=C1

IUPAC: 1-(4-bromo-3-fluorophenyl)butan-1-one

InChI: InChI=1S/C10H10BrFO/c1-2-3-10(13)7-4-5-8(11)9(12)6-7/h4-6H,2-3H2,1H3

Composition: C (49.01%), H (4.11%), Br (32.60%), F (7.75%), O (6.53%)

Molar Mass: 245.091

Atom Count: 23

Heavy Atom Count: 13

Properties
Properties
Common Names N/A
Aromatic Ring Count 1
Asymmetric Atom Count 0
Exact Mass 243.989906
Formal Charge 0
FSP3 0.3
Hetero Ring Count 0
Hydrogen Bond Acceptor Count 1
Hydrogen Bond Donor Count 0
InChIKey HWQXDKZINGHYPO-UHFFFAOYSA-N
Lipinski's Rule of Five 1
Molar Refractivity 53.53
Topological Polar Surface Area 17.07
Polarizability 20.31
Ring Count 1
Rotatable Bond Count 3

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Struchem co.,ltd
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Purity LeadTime Formula PacketSize UnitPrice
95% <5 Days C10H10BrFO $1,540.00-$2,860.00$1,540.00$1,760.00$2,860.00
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