Phosphonic acid, [[5-(3-fluorophenyl)-2-pyridinyl]methyl]-, diethyl ester

C16H19FNO3PCAS 380894-77-9323.30 g/mol

Open in Covalent MOL file
OPONFO
Aryl halidePhosphonate

Properties

Molecular formula
C16H19FNO3P
Molar mass
323.30 g/mol
Exact mass
323.1087 Da
logP
4.65Crippen estimate
Polar surface area
48.4 Ų
H-bond donors / acceptors
0 / 4
Rotatable bonds
7

Hazards

Warning
Irritant (GHS07)Environmental Hazard (GHS09)

Aggregated from the ECHA notifications, via PubChem; a share says how many notifiers assign that statement.

Precautionary statements

P264, P270, P273, P301+P317, P330, P391, P501

Identifiers

CAS number
380894-77-9
SMILES
CCOP(=O)(CC1=NC=C(C=C1)C2=CC(=CC=C2)F)OCC
InChIKey
CPOPYWOLIYKTLP-UHFFFAOYSA-N
InChI
InChI=1S/C16H19FNO3P/c1-3-20-22(19,21-4-2)12-16-9-8-14(11-18-16)13-6-5-7-15(17)10-13/h5-11H,3-4,12H2,1-2H3

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Similar compounds

Diethyl P-[(4-fluorophenyl)methyl]phosphonate63909-58-048 % similar Diethyl P-(phenylmethyl)phosphonate1080-32-646 % similar Tetraethyl ((1,1'-biphenyl)-4,4'-diylbis(methylene))bis(phosphonate)17919-34-545 % similar 4,4'-Bis(diethylmethylphosphonate)-2,2'-bipyridine176220-38-542 % similar 9,10-Bis(diethylphosphonomethyl)anthracene60974-92-742 % similar P,P,P′,P′-Tetraethyl P,P′-[1,4-phenylenebis(methylene)]bis[phosphonate]4546-04-741 % similar (3-Methoxybenzyl)phosphonic acid diethyl ester60815-18-141 % similar Diethyl 4-chlorobenzylphosphonate39225-17-739 % similar

Tanimoto similarity of circular fingerprints over the whole catalogue.

All similar compounds

Elsewhere

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