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2,5-difluorobenzoic acid

2,5-difluorobenzoic acid

CAS: 2991-28-8

Formula: C7H4F2O2

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

IUPAC: 2,5-difluorobenzoic acid

InChI: InChI=1S/C7H4F2O2/c8-4-1-2-6(9)5(3-4)7(10)11/h1-3H,(H,10,11)

Composition: C (53.18%), H (2.55%), F (24.03%), O (20.24%)

Molar Mass: 158.104

Atom Count: 15

Heavy Atom Count: 11

Properties
Properties
Common Names N/A
Aromatic Ring Count 1
Asymmetric Atom Count 0
Exact Mass 158.017935695
Formal Charge 0
FSP3 0
Hetero Ring Count 0
Hydrogen Bond Acceptor Count 2
Hydrogen Bond Donor Count 1
InChIKey LBQMIAVIGLLBGW-UHFFFAOYSA-N
Lipinski's Rule of Five 1
Molar Refractivity 33.75
Topological Polar Surface Area 37.3
Polarizability 12.27
Ring Count 1
Rotatable Bond Count 1

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OTAVA LTD.
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90% <10 Days 2991-28-8 $162.27$162.27
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98% <5 Days 2991-28-8 $380.00-$700.00$380.00$700.00
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