Methyl 4- (2-fluoroethoxy) benzoate

CAT: 0926-HFA83834-01Size: 50 mgDry Ice: NoHazardous: No

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CAT#:0926-HFA83834-01Size:50 mg

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CAS Number

132838-34-7

MDL Number

MFCD22371337

Smiles

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

Molecular Formula

C10H11FO3

Molecular Weight

198.19 g/mol

Controlled

Chemical Information

Methyl 4-(2-fluoroethoxy)benzoate

CAS Number	132838-34-7
PubChem CID	10943448
IUPAC Name	methyl 4-(2-fluoroethoxy)benzoate
Molecular Formula	C10H11FO3
Molecular Weight	198.19
XLogP	2.6
Topological Polar Surface Area	35.5
Hydrogen Bond Donor Count	0
Hydrogen Bond Acceptor Count	4
Rotatable Bond Count	5
Heavy Atom Count	14
Formal Charge	0
Complexity	176

SMILES

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

InChI

InChI=1S/C10H11FO3/c1-13-10(12)8-2-4-9(5-3-8)14-7-6-11/h2-5H,6-7H2,1H3

InChIKey

KODIHNQWZAHXMW-UHFFFAOYSA-N

Chemical Structure

2D Structure

CAS: 132838-34-7

CID: 10943448

Formula: C10H11FO3

MW: 198.19

Interactive 3D Structure

Loading 3D structure...

Computed Properties

Property	Value
Molecular Weight	198.19
XLogP3	2.6
Hydrogen Bond Donor Count	0
Hydrogen Bond Acceptor Count	4
Rotatable Bond Count	5
Exact Mass	198.06922237
Monoisotopic Mass	198.06922237
Topological Polar Surface Area	35.5 Å²
Heavy Atom Count	14
Formal Charge	0
Complexity	176
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
TDA61307-01	4- (2-Fluoroethoxy) phenol
VYB17926-01	4- (2-Fluoroethoxy) piperidine
BAA54712-01	4- (2-Fluoroethoxy) aniline
FM32265-01	Methyl 4-amino-2-methyl benzoate
EQA25544-01	Methyl 4-[ (2-chloroacetamido) methyl]benzoate
SLC49088-01	Methyl 4- (2-acetamidopropyl) benzoate
WBA19045	Methyl 4- (2-hydroxyethyl) benzoate
FM70524-01	Methyl 4 (2-hydroxyethoxy) benzoate
QCA78772-01	Methyl 4- (2-chloroethyl) benzoate
SBA49780-01	Methyl 4- (2-phenylethynyl) benzoate

Catalog	Name
OR5788-01	Methyl 2-[ (sulphamoyl) methyl]benzoate
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sc-269414	Methyl 2-[ (2-phenoxyphenylamino) -methyl]benzoate
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AB2600	Methyl 2- (methylamino) benzoate
sc-263494	Methyl 2- (trifluoromethyl) benzoate
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PC1001852-01	Methyl 2- (fluorosulfonyl) benzoate