Ethyl 2- (3-Fluorophenoxy) acetate

CAT: 0127-PC510104-01Size: 1 gDry Ice: NoHazardous: No

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CAT#:0127-PC510104-01Size:1 g

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CAS Number

777-70-8

MDL Number

MFCD06659702

Purity

=95%

Smiles

CCOC(=O)COc1cccc(F)c1

Chemical Information

Ethyl 2-(3-fluorophenoxy)acetate

CAS Number	777-70-8
PubChem CID	15078057
IUPAC Name	ethyl 2-(3-fluorophenoxy)acetate
Molecular Formula	C10H11FO3
Molecular Weight	198.19
XLogP	2.2
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	184

SMILES

CCOC(=O)COC1=CC(=CC=C1)F

InChI

InChI=1S/C10H11FO3/c1-2-13-10(12)7-14-9-5-3-4-8(11)6-9/h3-6H,2,7H2,1H3

InChIKey

UOUDEEISQIAYSK-UHFFFAOYSA-N

Chemical Structure

2D Structure

CAS: 777-70-8

CID: 15078057

Formula: C10H11FO3

MW: 198.19

Interactive 3D Structure

Loading 3D structure...

Computed Properties

Property	Value
Molecular Weight	198.19
XLogP3	2.2
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	184
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

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