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Details

Stereochemistry ACHIRAL
Molecular Formula C9H13NO.ClH
Molecular Weight 187.667
Optical Activity NONE
Defined Stereocenters 0 / 0
E/Z Centers 0
Charge 0

SHOW SMILES / InChI
Structure of 4-AMINO-2,3,6-TRIMETHYLPHENOL HYDROCHLORIDE

SMILES

Cl.CC1=C(O)C(C)=C(C)C(N)=C1

InChI

InChIKey=BQWKRBMMHCSQOJ-UHFFFAOYSA-N
InChI=1S/C9H13NO.ClH/c1-5-4-8(10)6(2)7(3)9(5)11;/h4,11H,10H2,1-3H3;1H

HIDE SMILES / InChI

Molecular Formula ClH
Molecular Weight 36.461
Charge 0
Count
Stereochemistry ACHIRAL
Additional Stereochemistry No
Defined Stereocenters 0 / 0
E/Z Centers 0
Optical Activity NONE

Molecular Formula C9H13NO
Molecular Weight 151.2056
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 Tue Apr 01 19:02:18 GMT 2025
Edited
by admin
on Tue Apr 01 19:02:18 GMT 2025
Record UNII
UHG5D2FX2P
Record Status Validated (UNII)
Record Version
  • Download
Name Type Language
4-AMINO-2,3,6-TRIMETHYLPHENOL HYDROCHLORIDE
Systematic Name English
PHENOL, 4-AMINO-2,3,6-TRIMETHYL-, HYDROCHLORIDE
Preferred Name English
PHENOL, 4-AMINO-2,3,6-TRIMETHYL-, HYDROCHLORIDE (1:1)
Systematic Name English
Code System Code Type Description
PUBCHEM
82665
Created by admin on Tue Apr 01 19:02:18 GMT 2025 , Edited by admin on Tue Apr 01 19:02:18 GMT 2025
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EPA CompTox
DTXSID2065094
Created by admin on Tue Apr 01 19:02:18 GMT 2025 , Edited by admin on Tue Apr 01 19:02:18 GMT 2025
PRIMARY
CAS
10486-47-2
Created by admin on Tue Apr 01 19:02:18 GMT 2025 , Edited by admin on Tue Apr 01 19:02:18 GMT 2025
PRIMARY
ECHA (EC/EINECS)
234-007-7
Created by admin on Tue Apr 01 19:02:18 GMT 2025 , Edited by admin on Tue Apr 01 19:02:18 GMT 2025
PRIMARY
FDA UNII
UHG5D2FX2P
Created by admin on Tue Apr 01 19:02:18 GMT 2025 , Edited by admin on Tue Apr 01 19:02:18 GMT 2025
PRIMARY