2- (4-Bromo-2-fluorophenoxy) benzaldehyde

CAT: 0926-NNA39363-01Size: 50 mgDry Ice: NoHazardous: No

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CAT#:0926-NNA39363-01Size:50 mg

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CAS Number

338393-63-8

MDL Number

MFCD01568895

Smiles

C1=CC=C (C (=C1) C=O) OC2=C (C=C (C=C2) Br) F

Molecular Formula

C13H8BrFO2

Molecular Weight

295.1 g/mol

Controlled

Chemical Information

2-(4-Bromo-2-fluorophenoxy)benzaldehyde

CAS Number	338393-63-8
PubChem CID	1490877
IUPAC Name	2-(4-bromo-2-fluorophenoxy)benzaldehyde
Molecular Formula	C13H8BrFO2
Molecular Weight	295.10
XLogP	3.7
Topological Polar Surface Area	26.3
Hydrogen Bond Donor Count	0
Hydrogen Bond Acceptor Count	3
Rotatable Bond Count	3
Heavy Atom Count	17
Formal Charge	0
Complexity	262

SMILES

C1=CC=C(C(=C1)C=O)OC2=C(C=C(C=C2)Br)F

InChI

InChI=1S/C13H8BrFO2/c14-10-5-6-13(11(15)7-10)17-12-4-2-1-3-9(12)8-16/h1-8H

InChIKey

BFGMNJVBGLRRFI-UHFFFAOYSA-N

Chemical Structure

2D Structure

CAS: 338393-63-8

CID: 1490877

Formula: C13H8BrFO2

MW: 295.10

Interactive 3D Structure

Loading 3D structure...

Computed Properties

Property	Value
Molecular Weight	295.10
XLogP3	3.7
Hydrogen Bond Donor Count	0
Hydrogen Bond Acceptor Count	3
Rotatable Bond Count	3
Exact Mass	293.96917
Monoisotopic Mass	293.96917
Topological Polar Surface Area	26.3 Å²
Heavy Atom Count	17
Formal Charge	0
Complexity	262
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
FQB76344-01	2- (2-Chloro-4-fluorophenoxy) benzaldehyde
WQB23315-01	3-Fluoro-4- (2-fluorophenoxy) benzaldehyde
VQB93153-01	2- (3-Fluorophenoxy) benzaldehyde
PMB75829-01	4- (3-Fluorophenoxy) benzaldehyde
PZB61129-01	4- (4-Bromo-2-fluorophenoxy) oxane
BAA71683-01	Ethyl 2- (4-bromo-2-fluorophenoxy) acetate
MKD65330-01	2- (4-Bromo-2-fluorophenoxy) propanoyl chloride
ZZB13893-01	Methyl 2- (4-bromo-2-fluorophenoxy) propanoate
TLB35011-01	4-Bromo-2- (methylsulfanyl) benzaldehyde
SDC64667-01	4-Bromo-2- (ethylsulfanyl) benzaldehyde

Catalog	Name
PC10172-01	2- (4-Fluorophenoxy) benzaldehyde
PC300611-01	4- (2-Fluorophenoxy) benzaldehyde
PC300609-01	4- (4-Fluorophenoxy) benzaldehyde
PC1011212	4- ((2-fluorophenoxy) methyl) benzaldehyde
PC10206	2- (4-Fluorophenoxy) benzaldehyde oxime
PC300613-01	4- (3-Fluorophenoxy) benzaldehyde
PC200589	3- (4-Fluorophenoxy) benzaldehyde
PC300604-01	2- (2-Fluorophenoxy) benzaldehyde
sc-299838A	5-Fluoro-2- (4-fluorophenoxy) benzaldehyde
PC1011276	4- ((4-fluorophenoxy) methyl) benzaldehyde