Alpha-Fluorophenylacetic acid

CAT: 0024-sc-257082Size: 1 gDry Ice: NoHazardous: No

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CAT#:0024-sc-257082Size:1 g

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CAS Number

1578-63-8

Chemical Information

Fluorophenylacetic acid

CAS Number	1578-63-8
PubChem CID	102649
IUPAC Name	2-fluoro-2-phenylacetic acid
Molecular Formula	C8H7FO2
Molecular Weight	154.14
XLogP	1.9
Topological Polar Surface Area	37.3
Hydrogen Bond Donor Count	1
Hydrogen Bond Acceptor Count	3
Rotatable Bond Count	2
Heavy Atom Count	11
Formal Charge	0
Complexity	141

SMILES

C1=CC=C(C=C1)C(C(=O)O)F

InChI

InChI=1S/C8H7FO2/c9-7(8(10)11)6-4-2-1-3-5-6/h1-5,7H,(H,10,11)

InChIKey

ATPPNMLQNZHDOG-UHFFFAOYSA-N

Chemical Structure

2D Structure

CAS: 1578-63-8

CID: 102649

Formula: C8H7FO2

MW: 154.14

Interactive 3D Structure

Loading 3D structure...

Computed Properties

Property	Value
Molecular Weight	154.14
XLogP3	1.9
Hydrogen Bond Donor Count	1
Hydrogen Bond Acceptor Count	3
Rotatable Bond Count	2
Exact Mass	154.04300762
Monoisotopic Mass	154.04300762
Topological Polar Surface Area	37.3 Å²
Heavy Atom Count	11
Formal Charge	0
Complexity	141
Isotope Atom Count	0
Defined Atom Stereocenter Count	0
Undefined Atom Stereocenter Count	1
Defined Bond Stereocenter Count	0
Undefined Bond Stereocenter Count	0
Covalently-Bonded Unit Count	1
Compound Is Canonicalized	Yes

Catalog	Name
sc-231725	3-Fluorophenylacetic acid
sc-254673	4-Fluorophenylacetic acid
sc-254252	2-Fluorophenylacetic acid
sc-233761	α-Bromo-4-fluorophenylacetic acid
sc-312551	3-Bromo-4-fluorophenylacetic acid
sc-307025A	2-Bromo-5-fluorophenylacetic acid
sc-307007	2-Bromo-4-fluorophenylacetic acid
sc-299795	5-Chloro-2-fluorophenylacetic acid
sc-307025	2-Bromo-5-fluorophenylacetic acid
sc-261758A	4-Bromo-2-fluorophenylacetic acid

Catalog	Name
276748-01	3-Fluorophenylacetic acid
276747-01	4-Fluorophenylacetic acid
276687-01	2-Fluorophenylacetic acid
F03950-01	P-Fluorophenylacetic Acid 98%
F03940-01	M-Fluorophenylacetic acid 97%
F03930-01	O-Fluorophenylacetic acid 97%
AFC96439	3-Bromo-2-fluorophenylacetic acid
LKA76296	3-Chloro-2-fluorophenylacetic acid
415899-01	2-Bromo-4-fluorophenylacetic acid
TRC-C584730-100MG	3-Chloro-4-fluorophenylacetic acid