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Details

Stereochemistry ACHIRAL
Molecular Formula 2C7H8FNO.H2O4S
Molecular Weight 380.364
Optical Activity NONE
Defined Stereocenters 0 / 0
E/Z Centers 0
Charge 0

SHOW SMILES / InChI
Structure of 5-AMINO-4-FLUORO-2-METHYLPHENOL SULFATE

SMILES

OS(O)(=O)=O.CC1=C(O)C=C(N)C(F)=C1.CC2=C(O)C=C(N)C(F)=C2

InChI

InChIKey=FRZRJNBRHWNCDB-UHFFFAOYSA-N
InChI=1S/2C7H8FNO.H2O4S/c2*1-4-2-5(8)6(9)3-7(4)10;1-5(2,3)4/h2*2-3,10H,9H2,1H3;(H2,1,2,3,4)

HIDE SMILES / InChI

Molecular Formula H2O4S
Molecular Weight 98.078
Charge 0
Count
Stereochemistry ACHIRAL
Additional Stereochemistry No
Defined Stereocenters 0 / 0
E/Z Centers 0
Optical Activity NONE

Molecular Formula C7H8FNO
Molecular Weight 141.1429
Charge 0
Count
Stereochemistry ACHIRAL
Additional Stereochemistry No
Defined Stereocenters 0 / 0
E/Z Centers 0
Optical Activity NONE

Approval Year

Substance Class Chemical
Created
by admin
on Mon Mar 31 20:46:47 GMT 2025
Edited
by admin
on Mon Mar 31 20:46:47 GMT 2025
Record UNII
D3JG7RM155
Record Status Validated (UNII)
Record Version
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Name Type Language
5-AMINO-4-FLUORO-2-METHYLPHENOL SULFATE
INCI  
INCI  
Official Name English
PHENOL, 5-AMINO-4-FLUORO-2-METHYL-, SULFATE (2:1)
Preferred Name English
Code System Code Type Description
FDA UNII
D3JG7RM155
Created by admin on Mon Mar 31 20:46:47 GMT 2025 , Edited by admin on Mon Mar 31 20:46:47 GMT 2025
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CAS
163183-01-5
Created by admin on Mon Mar 31 20:46:47 GMT 2025 , Edited by admin on Mon Mar 31 20:46:47 GMT 2025
PRIMARY
PUBCHEM
71587558
Created by admin on Mon Mar 31 20:46:47 GMT 2025 , Edited by admin on Mon Mar 31 20:46:47 GMT 2025
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