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3-chloro-5-fluorobenzoic acid

3-chloro-5-fluorobenzoic acid

CAS: 25026-64-6

Formula: C7H4ClFO2

SMILES: OC(=O)C1=CC(Cl)=CC(F)=C1

IUPAC: 3-chloro-5-fluorobenzoic acid

InChI: InChI=1S/C7H4ClFO2/c8-5-1-4(7(10)11)2-6(9)3-5/h1-3H,(H,10,11)

Composition: C (48.17%), H (2.31%), Cl (20.31%), F (10.88%), O (18.33%)

Molar Mass: 174.56

Atom Count: 15

Heavy Atom Count: 11

Properties
Properties
Common Names N/A
Aromatic Ring Count 1
Asymmetric Atom Count 0
Exact Mass 173.9883852
Formal Charge 0
FSP3 0
Hetero Ring Count 0
Hydrogen Bond Acceptor Count 2
Hydrogen Bond Donor Count 1
InChIKey QFMRANWPGGSNHS-UHFFFAOYSA-N
Lipinski's Rule of Five 1
Molar Refractivity 38.34
Topological Polar Surface Area 37.3
Polarizability 14.39
Ring Count 1
Rotatable Bond Count 1

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Struchem co.,ltd
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Purity LeadTime CAS PacketSize UnitPrice
98% <5 Days 25026-64-6 $480.00-$2,508.00$480.00$738.00$2,508.00
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Kinentia Biosciences LLC
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Purity LeadTime CAS PacketSize UnitPrice
95% <14 Days 25026-64-6 $136.08$136.08
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