Text Search
Structure Search

2,6-difluoro-4-formylbenzoic acid

2,6-difluoro-4-formylbenzoic acid

CAS: 1242070-98-9

Formula: C8H4F2O3

SMILES: OC(=O)C1=C(F)C=C(C=O)C=C1F

IUPAC: 2,6-difluoro-4-formylbenzoic acid

InChI: InChI=1S/C8H4F2O3/c9-5-1-4(3-11)2-6(10)7(5)8(12)13/h1-3H,(H,12,13)

Composition: C (51.63%), H (2.17%), F (20.42%), O (25.79%)

Molar Mass: 186.114

Atom Count: 17

Heavy Atom Count: 13

Properties
Properties
Common Names N/A
Aromatic Ring Count 1
Asymmetric Atom Count 0
Exact Mass 186.012850315
Formal Charge 0
FSP3 0
Hetero Ring Count 0
Hydrogen Bond Acceptor Count 3
Hydrogen Bond Donor Count 1
InChIKey KUZZMQQMBLSIOJ-UHFFFAOYSA-N
Lipinski's Rule of Five 1
Molar Refractivity 40.33
Topological Polar Surface Area 54.37
Polarizability 14.25
Ring Count 1
Rotatable Bond Count 2

Suppliers

Purity (%)
-
Ships Within
Days
Packet Size
| Clear Filters
Molecule Market Select
Purity LeadTime CAS PacketSize UnitPrice
98% <7 Days 1242070-98-9 $38.30-$136.62$38.30$69.35$136.62
Request Quote
AA BLOCKS INC
Supplier Profile
Purity LeadTime CAS PacketSize UnitPrice
98% <6 Days 1242070-98-9 $80.50-$207.00$80.50$120.75$207.00
Request Quote