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Methyl (4-aminophenoxy) acetate

CAT: 0024-sc-351816ASize: 1 gDry Ice: NoHazardous: No
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CAS Number
59954-04-0

Chemical Information

Methyl(4-aminophenoxy)acetate
CAS Number59954-04-0
PubChem CID6422115
IUPAC Namemethyl 2-(4-aminophenoxy)acetate
Molecular FormulaC9H11NO3
Molecular Weight181.19
XLogP0.7
Topological Polar Surface Area61.6
Hydrogen Bond Donor Count1
Hydrogen Bond Acceptor Count4
Rotatable Bond Count4
Heavy Atom Count13
Formal Charge0
Complexity164
SMILES
COC(=O)COC1=CC=C(C=C1)N
InChI
InChI=1S/C9H11NO3/c1-12-9(11)6-13-8-4-2-7(10)3-5-8/h2-5H,6,10H2,1H3
InChIKey
YDWPOGYTJVQQIL-UHFFFAOYSA-N
Chemical Structure
2D Structure
2D structure of Methyl(4-aminophenoxy)acetate
CAS: 59954-04-0
CID: 6422115
Formula: C9H11NO3
MW: 181.19
Interactive 3D Structure
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View on PubChemRaw 3D data
Computed Properties
PropertyValue
Molecular Weight181.19
XLogP30.7
Hydrogen Bond Donor Count1
Hydrogen Bond Acceptor Count4
Rotatable Bond Count4
Exact Mass181.07389321
Monoisotopic Mass181.07389321
Topological Polar Surface Area61.6 Ų
Heavy Atom Count13
Formal Charge0
Complexity164
Isotope Atom Count0
Defined Atom Stereocenter Count0
Undefined Atom Stereocenter Count0
Defined Bond Stereocenter Count0
Undefined Bond Stereocenter Count0
Covalently-Bonded Unit Count1
Compound Is CanonicalizedYes

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CatalogName
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sc-328618Methyl 4- (4-aminophenoxy) benzoate
sc-328199AMethyl 2- (4-aminophenoxy) benzenecarboxylate
sc-351729AEthyl (3-aminophenoxy) acetate
sc-328596Methyl 4- (2-aminophenoxy) benzoate
sc-328199Methyl 2- (4-aminophenoxy) benzenecarboxylate
sc-351729Ethyl (3-aminophenoxy) acetate
sc-301041Methyl 3- (4-aminophenoxy) -2-thiophenecarboxylate

Alternative Products

CatalogName
M287305Methyl (4-Aminophenoxy)acetate
OR943322-01Methyl (4-aminophenoxy) acetate
IGA19647-01Methyl 2- (3-aminophenoxy) acetate
HY-W005340-01Methyl (4-cyanophenyl) acetate
OR32624-01(4-Chlorophenyl) methyl acetate
OR956383-01Methyl (4-nitrophenyl) acetate
FM67976-01Methyl (4-butoxyphenyl) acetate
281813-01Methyl- (4-bromophenoxy) acetate
454588-01Methyl (4-cyanophenoxy) acetate
JH657812(4-methylphenyl) methyl acetate

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