4-Amino-3-fluorophenol

CAT: 0127-PC1076J-01Size: 5 gDry Ice: NoHazardous: No

1 / 1

CAT#:0127-PC1076J-01Size:5 g

Selected

24/48H Stock Items & 2 to 6 Weeks non Stock Items.

Quick Request Actions

CAS Number

399-95-1

Synonyms

2-Fluoro-4-hydroxyaniline

MDL Number

MFCD00077452

Purity

=95%

Smiles

Nc1ccc(O)cc1F

Storage Conditions

Store at 2-8°C

Chemical Information

4-Amino-3-fluorophenol

CAS Number	399-95-1
PubChem CID	2735919
IUPAC Name	4-amino-3-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=C1O)F)N

InChI

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

InChIKey

MNPLTKHJEAFOCA-UHFFFAOYSA-N

Chemical Structure

2D Structure

CAS: 399-95-1

CID: 2735919

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
MBS6043217-01	4-Amino-3-fluorophenol
FA42957-01	3-Amino-4-fluorophenol
abx183507-01	4-Amino-2-fluorophenol
FA53922-01	2-Amino-4-fluorophenol
TRC-A320145-1G	2-Amino-3-bromo-4-fluorophenol
A609780	3-Amino-2-fluorophenol
260398-01	2-Amino-3-fluorophenol
KQD93211-01	2-Amino-4-chloro-3-fluorophenol hydrochloride
437815-01	6-Amino-2,4-dibromo-3-fluorophenol
415018-01	2-Amino-3-fluorophenol hydrochloride