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2-(difluoromethoxy)-6-fluorobenzonitrile

2-(difluoromethoxy)-6-fluorobenzonitrile

CAS: 221202-14-8

Formula: C8H4F3NO

SMILES: FC(F)OC1=C(C#N)C(F)=CC=C1

IUPAC: 2-(difluoromethoxy)-6-fluorobenzonitrile

InChI: InChI=1S/C8H4F3NO/c9-6-2-1-3-7(5(6)4-12)13-8(10)11/h1-3,8H

Composition: C (51.35%), H (2.15%), F (30.46%), N (7.49%), O (8.55%)

Molar Mass: 187.121

Atom Count: 17

Heavy Atom Count: 13

Properties
Properties
Common Names N/A
Aromatic Ring Count 1
Asymmetric Atom Count 0
Exact Mass 187.024498242
Formal Charge 0
FSP3 0.12
Hetero Ring Count 0
Hydrogen Bond Acceptor Count 2
Hydrogen Bond Donor Count 0
InChIKey AHBZEVXFBMJSNR-UHFFFAOYSA-N
Lipinski's Rule of Five 1
Molar Refractivity 38.47
Topological Polar Surface Area 33.02
Polarizability 14.12
Ring Count 1
Rotatable Bond Count 2

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Purity LeadTime CAS UnitPrice
98% <10 Days 221202-14-8 Quote Only
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Purity LeadTime CAS PacketSize UnitPrice
97% <5 Days 221202-14-8 $13.87-$167.71$13.87$51.70$167.71
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