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5-chloro-2-(4-fluorophenoxymethyl)-1H-1,3-benzodiazole

5-chloro-2-(4-fluorophenoxymethyl)-1H-1,3-benzodiazole

Formula: C14H10ClFN2O

SMILES: FC1=CC=C(OCC2=NC3=CC(Cl)=CC=C3N2)C=C1

IUPAC: 5-chloro-2-[(4-fluorophenoxy)methyl]-1H-1,3-benzodiazole

InChI: InChI=1S/C14H10ClFN2O/c15-9-1-6-12-13(7-9)18-14(17-12)8-19-11-4-2-10(16)3-5-11/h1-7H,8H2,(H,17,18)

Composition: C (60.77%), H (3.64%), Cl (12.81%), F (6.87%), N (10.12%), O (5.78%)

Molar Mass: 276.7

Atom Count: 29

Heavy Atom Count: 19

Properties
Properties
Common Names N/A
Aromatic Ring Count 3
Asymmetric Atom Count 0
Exact Mass 276.0465688
Formal Charge 0
FSP3 0.07
Hetero Ring Count 1
Hydrogen Bond Acceptor Count 2
Hydrogen Bond Donor Count 1
InChIKey IKDFSXZNJVAPDV-UHFFFAOYSA-N
Lipinski's Rule of Five 1
Molar Refractivity 70.39
Topological Polar Surface Area 37.91
Polarizability 28.28
Ring Count 3
Rotatable Bond Count 3

Suppliers

Purity (%)
-
Ships Within
Days
Packet Size
Molecule Market Select
Purity LeadTime Formula PacketSize UnitPrice
90% <16 Days C14H10ClFN2O $33.80-$156.00$33.80$52.00$67.60$93.60$156.00
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