Methyl 2- (4-hydroxyphenoxy) acetate

CAT: 0926-VCA06775-01Size: 50 mgDry Ice: NoHazardous: No

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CAT#:0926-VCA06775-01Size:50 mg

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CAS Number

70067-75-3

MDL Number

MFCD11046458

Smiles

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

Molecular Formula

C9H10O4

Molecular Weight

182.17 g/mol

Controlled

Chemical Information

Methyl 2-(4-hydroxyphenoxy)acetate

CAS Number	70067-75-3
PubChem CID	602731
IUPAC Name	methyl 2-(4-hydroxyphenoxy)acetate
Molecular Formula	C9H10O4
Molecular Weight	182.17
XLogP	1.1
Topological Polar Surface Area	55.8
Hydrogen Bond Donor Count	1
Hydrogen Bond Acceptor Count	4
Rotatable Bond Count	4
Heavy Atom Count	13
Formal Charge	0
Complexity	161

SMILES

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

InChI

InChI=1S/C9H10O4/c1-12-9(11)6-13-8-4-2-7(10)3-5-8/h2-5,10H,6H2,1H3

InChIKey

OITXOTZGDJLEBU-UHFFFAOYSA-N

Chemical Structure

2D Structure

CAS: 70067-75-3

CID: 602731

Formula: C9H10O4

MW: 182.17

Interactive 3D Structure

Loading 3D structure...

Computed Properties

Property	Value
Molecular Weight	182.17
XLogP3	1.1
Hydrogen Bond Donor Count	1
Hydrogen Bond Acceptor Count	4
Rotatable Bond Count	4
Exact Mass	182.05790880
Monoisotopic Mass	182.05790880
Topological Polar Surface Area	55.8 Å²
Heavy Atom Count	13
Formal Charge	0
Complexity	161
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
VAA87228-01	Ethyl 2- (4-hydroxyphenoxy) acetate
ZDA18663	Ethyl 2- (2-hydroxyphenoxy) acetate
WEA21026-01	Methyl (2S) -2- (4-hydroxyphenoxy) propanoate
XAA44614-01	2- (4-Hydroxyphenoxy) acetamide
YAA99090-01	2- (4-Hydroxyphenoxy) phenol
CFA43743-01	2- (4-Hydroxyphenoxy) propanamide
ZDA36295-01	Methyl 2- (4-aminobenzenesulfonamido) acetate
UNA30737-01	Methyl 2- (4-methylcyclohexyl) acetate
BJA39821-01	Methyl 2- (4-aminobenzenesulfonyl) acetate
BJA39671-01	Methyl 2- (4-fluorobenzenesulfonyl) acetate

Catalog	Name
OR32563-01	Methyl 2- (4-hydroxyphenoxy) acetate
454963-01	Methyl 2-Hydroxy-2- (4- (4-hydroxyphenoxy) -3,5-diiodophenyl) acetate
HY-W005340-01	Methyl (4-cyanophenyl) acetate
sc-228476	Methyl (4-chlorobenzoyl) acetate
OR32624-01	(4-Chlorophenyl) methyl acetate
OR956383-01	Methyl (4-nitrophenyl) acetate
sc-263471	Methyl (4-boronobenzoylamino) acetate
281813-01	Methyl- (4-bromophenoxy) acetate
454588-01	Methyl (4-cyanophenoxy) acetate
454586-01	Methyl (4-Aminophenoxy) acetate