2- (4-methoxyphenoxy) acetaldehyde

CAT: 0127-OR1093466-01Size: 250 mgDry Ice: NoHazardous: No

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CAT#:0127-OR1093466-01Size:250 mg

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CAS Number

68426-09-5

MDL Number

MFCD09883150

Purity

95%

Smiles

C1c (ccc (c1) OCC=O) OC

Chemical Information

Acetaldehyde, (4-methoxyphenoxy)-

CAS Number	68426-09-5
PubChem CID	96383
IUPAC Name	2-(4-methoxyphenoxy)acetaldehyde
Molecular Formula	C9H10O3
Molecular Weight	166.17
XLogP	1.4
Topological Polar Surface Area	35.5
Hydrogen Bond Donor Count	0
Hydrogen Bond Acceptor Count	3
Rotatable Bond Count	4
Heavy Atom Count	12
Formal Charge	0
Complexity	128

SMILES

COC1=CC=C(C=C1)OCC=O

InChI

InChI=1S/C9H10O3/c1-11-8-2-4-9(5-3-8)12-7-6-10/h2-6H,7H2,1H3

InChIKey

CUMIGPPRWNRSMW-UHFFFAOYSA-N

Chemical Structure

2D Structure

CAS: 68426-09-5

CID: 96383

Formula: C9H10O3

MW: 166.17

Interactive 3D Structure

Loading 3D structure...

Computed Properties

Property	Value
Molecular Weight	166.17
XLogP3	1.4
Hydrogen Bond Donor Count	0
Hydrogen Bond Acceptor Count	3
Rotatable Bond Count	4
Exact Mass	166.062994177
Monoisotopic Mass	166.062994177
Topological Polar Surface Area	35.5 Å²
Heavy Atom Count	12
Formal Charge	0
Complexity	128
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
OR1071218-01	2- (4,4-Dimethylcyclohexyl) acetaldehyde
OR1054334	2- (4-Nitrophenyl) acetaldehyde
PC904883-01	2- (4-fluorophenyl) acetaldehyde
OR927834-01	2- (4-chlorophenyl) acetaldehyde
OR1027149-01	Acetaldehyde 2,4-Dinitrophenylhydrazone
OR29620-01	2- (4-Methoxyphenoxy) acetonitrile
OR11344-01	4- (2-Methoxyphenoxy) aniline
OR11361-01	4- (2-Methoxyphenoxy) iodobenzene
OR12731-01	2- (4-Methoxyphenoxy) propylamine
OR89954-01	2- (4-Methoxyphenoxy) benzaldehyde

Catalog	Name
282239-01	2- (2-Methoxyphenoxy) acetaldehyde
MBS6088279-01	2-(2-Methoxyphenoxy)acetaldehyde
AR-C01561-01	2- ((2- (2-methoxyphenoxy) ethyl) amino) acetaldehyde
412869-01	2- ((2- (2-Methoxyphenoxy) ethyl) amino) acetaldehyde Hydrochloride
TRC-M264975-100MG	2-((2-(2-Methoxyphenoxy)ethyl)amino)acetaldehyde Hydrochloride
sc-277396	(4-Fluorophenyl) acetaldehyde
BAA46005-01	(4-Nitrophenyl) acetaldehyde
431297-01	(4-Bromophenyl) acetaldehyde
269838-01	(4-Chlorophenyl) acetaldehyde
AAA10409	(4-Methylphenyl) acetaldehyde