(E) -4- (((4-Fluorophenyl) imino) methyl) phenol

CAT: 0127-PC1006765-01Size: 25 gDry Ice: NoHazardous: No

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CAT#:0127-PC1006765-01Size:25 g

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CAS Number

942485-62-3

MDL Number

MFCD00029739

Purity

98%

Smiles

OC1=CC=C(/C=N/C2=CC=C(F)C=C2)C=C1

Chemical Information

4-[[(4-Fluorophenyl)imino]methyl]phenol

See also: 4-(4-Hydroxy benzylidene) Fluoroaniline (annotation moved to).

CAS Number	942485-62-3
PubChem CID	720254
IUPAC Name	4-[(4-fluorophenyl)iminomethyl]phenol
Molecular Formula	C13H10FNO
Molecular Weight	215.22
XLogP	2.6
Topological Polar Surface Area	32.6
Hydrogen Bond Donor Count	1
Hydrogen Bond Acceptor Count	3
Rotatable Bond Count	2
Heavy Atom Count	16
Formal Charge	0
Complexity	228

SMILES

C1=CC(=CC=C1C=NC2=CC=C(C=C2)F)O

InChI

InChI=1S/C13H10FNO/c14-11-3-5-12(6-4-11)15-9-10-1-7-13(16)8-2-10/h1-9,16H

InChIKey

VNNJGDYPPLXJFF-UHFFFAOYSA-N

Chemical Structure

2D Structure

CAS: 942485-62-3

CID: 720254

Formula: C13H10FNO

MW: 215.22

Interactive 3D Structure

Loading 3D structure...

Computed Properties

Property	Value
Molecular Weight	215.22
XLogP3	2.6
Hydrogen Bond Donor Count	1
Hydrogen Bond Acceptor Count	3
Rotatable Bond Count	2
Exact Mass	215.074642105
Monoisotopic Mass	215.074642105
Topological Polar Surface Area	32.6 Å²
Heavy Atom Count	16
Formal Charge	0
Complexity	228
Isotope Atom Count	0
Defined Atom Stereocenter Count	0
Undefined Atom Stereocenter Count	0
Defined Bond Stereocenter Count	0
Undefined Bond Stereocenter Count	0
Covalently-Bonded Unit Count	1
Compound Is Canonicalized	Yes

Catalog	Name
PC105243-01	4-[[ (4-Fluorophenyl) Imino]Methyl]Phenol
PC108814-01	2-{[ (4-Fluorophenyl) Imino]Methyl}Phenol
PC1001975-01	(4-Fluorophenyl) (imino) (methyl) -l6-sulfanone
OR21082	2-{[ (4-Chlorophenyl) imino]methyl}phenol
OR21086	4-bromo-2-{[ (4-ethoxyphenyl) imino]methyl}phenol
OR21085	4-bromo-2-{[ (4-methoxyphenyl) imino]methyl}phenol
OR21087	4-bromo-2-{[ (4-chlorophenyl) imino]methyl}phenol
OR27387	4- ({[ (2,6-dichloro-4-pyridyl) methyl]imino}methyl) phenol
PC101812-01	2-{[ (4-fluorophenyl) amino]methyl}phenol
PC31155	4-bromo-2- ({[3- (trifluoromethyl) phenyl]imino}methyl) phenol

Catalog	Name
TRC-F595720-250MG	4-{[(p-Fluorophenyl)imino]methyl}phenol
429874-01	4-[[ (3-Fluorophenyl) imino]methyl]phenol
161171	4-{[ (p-Fluorophenyl) imino]methyl}phenol
F489635	4-[[(3-Fluorophenyl)imino]methyl]phenol
HY-W751537-01	4-[[ (4-Fluorophenyl) imino]methyl]phenol-13C6
HY-W699637-01	4-[[ (4-Fluorophenyl) imino]methyl]phenol-d4
TRC-F595724-1MG	4-{[(p-Fluorophenyl)imino]methyl}phenol-13C6
TRC-F595722-100MG	4-{[(p-Fluorophenyl)imino]methyl}phenol-d4
CKA57377-01	2-[ (E) -[ (4-Fluorophenyl) imino]methyl]phenol
F5272-55	4-{[ (p-Fluorophenyl) imino]methyl}phenol-d4