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Details

Stereochemistry ACHIRAL
Molecular Formula C9H9NO4.ClH
Molecular Weight 231.633
Optical Activity NONE
Defined Stereocenters 0 / 0
E/Z Centers 0
Charge 0

SHOW SMILES / InChI
Structure of Benzeneacetic acid, 2,4-dihydroxy-?-imino-, methyl ester, hydrochloride

SMILES

Cl.COC(=O)C(=N)C1=CC=C(O)C=C1O

InChI

InChIKey=FDLZWPISXDXKKF-UHFFFAOYSA-N
InChI=1S/C9H9NO4.ClH/c1-14-9(13)8(10)6-3-2-5(11)4-7(6)12;/h2-4,10-12H,1H3;1H

HIDE SMILES / InChI

Molecular Formula C9H9NO4
Molecular Weight 195.1721
Charge 0
Count
Stereochemistry ACHIRAL
Additional Stereochemistry No
Defined Stereocenters 0 / 0
E/Z Centers 0
Optical Activity NONE

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

Approval Year

Substance Class Chemical
Created
by admin
on Tue Apr 01 19:33:22 GMT 2025
Edited
by admin
on Tue Apr 01 19:33:22 GMT 2025
Record UNII
5DNM82X3VW
Record Status Validated (UNII)
Record Version
  • Download
Name Type Language
Benzeneacetic acid, 2,4-dihydroxy-?-imino-, methyl ester, hydrochloride (1:1)
Preferred Name English
Benzeneacetic acid, 2,4-dihydroxy-?-imino-, methyl ester, hydrochloride
Common Name English
Code System Code Type Description
ECHA (EC/EINECS)
267-261-2
Created by admin on Tue Apr 01 19:33:22 GMT 2025 , Edited by admin on Tue Apr 01 19:33:22 GMT 2025
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EPA CompTox
DTXSID9070664
Created by admin on Tue Apr 01 19:33:22 GMT 2025 , Edited by admin on Tue Apr 01 19:33:22 GMT 2025
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FDA UNII
5DNM82X3VW
Created by admin on Tue Apr 01 19:33:22 GMT 2025 , Edited by admin on Tue Apr 01 19:33:22 GMT 2025
PRIMARY
PUBCHEM
105723
Created by admin on Tue Apr 01 19:33:22 GMT 2025 , Edited by admin on Tue Apr 01 19:33:22 GMT 2025
PRIMARY
CAS
67828-39-1
Created by admin on Tue Apr 01 19:33:22 GMT 2025 , Edited by admin on Tue Apr 01 19:33:22 GMT 2025
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