2-Amino-5-fluorophenol

CAT: 0024-sc-281652Size: 5 gDry Ice: NoHazardous: No

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CAT#:0024-sc-281652Size:5 g

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CAS Number

53981-24-1

Chemical Information

2-Amino-5-fluorophenol

CAS Number	53981-24-1
PubChem CID	185763
IUPAC Name	2-amino-5-fluorophenol
Molecular Formula	C6H6FNO
Molecular Weight	127.12
XLogP	1.1
Topological Polar Surface Area	46.3
Hydrogen Bond Donor Count	2
Hydrogen Bond Acceptor Count	3
Rotatable Bond Count	0
Heavy Atom Count	9
Formal Charge	0
Complexity	99

SMILES

C1=CC(=C(C=C1F)O)N

InChI

InChI=1S/C6H6FNO/c7-4-1-2-5(8)6(9)3-4/h1-3,9H,8H2

InChIKey

IIDUNAVOCYMUFB-UHFFFAOYSA-N

Chemical Structure

2D Structure

CAS: 53981-24-1

CID: 185763

Formula: C6H6FNO

MW: 127.12

Interactive 3D Structure

Loading 3D structure...

Computed Properties

Property	Value
Molecular Weight	127.12
XLogP3	1.1
Hydrogen Bond Donor Count	2
Hydrogen Bond Acceptor Count	3
Rotatable Bond Count	0
Exact Mass	127.043341977
Monoisotopic Mass	127.043341977
Topological Polar Surface Area	46.3 Å²
Heavy Atom Count	9
Formal Charge	0
Complexity	99.1
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
sc-259495A	2-Amino-6-fluorophenol
sc-259495	2-Amino-6-fluorophenol
sc-298240A	2-Amino-3-fluorophenol
sc-298240	2-Amino-3-fluorophenol
sc-229872	2-Amino-4-fluorophenol
sc-277005	4-Amino-2-fluorophenol
sc-480877	2-[ (1R) -1-Amino-2-methoxyethyl]-5-fluorophenol hydrochloride
sc-225221	2-Bromo-5-fluorophenol
sc-274558	2-Chloro-5-fluorophenol
sc-277019	4-Amino-3-fluorophenol