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Details

Stereochemistry ACHIRAL
Molecular Formula C6H5ClN2O3.ClH
Molecular Weight 225.029
Optical Activity NONE
Defined Stereocenters 0 / 0
E/Z Centers 0
Charge 0

SHOW SMILES / InChI
Structure of Phenol, 2-amino-4-chloro-5-nitro-, monohydrochloride

SMILES

Cl.NC1=CC(Cl)=C(C=C1O)[N+]([O-])=O

InChI

InChIKey=UZYGGKCJOSXNMS-UHFFFAOYSA-N
InChI=1S/C6H5ClN2O3.ClH/c7-3-1-4(8)6(10)2-5(3)9(11)12;/h1-2,10H,8H2;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 C6H5ClN2O3
Molecular Weight 188.569
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 19:23:13 GMT 2025
Edited
by admin
on Tue Apr 01 19:23:13 GMT 2025
Record UNII
QLS5RJ4YAU
Record Status Validated (UNII)
Record Version
  • Download
Name Type Language
Phenol, 2-amino-4-chloro-5-nitro-, monohydrochloride
Systematic Name English
Phenol, 2-amino-4-chloro-5-nitro-, hydrochloride (1:1)
Preferred Name English
Code System Code Type Description
CAS
67815-67-2
Created by admin on Tue Apr 01 19:23:13 GMT 2025 , Edited by admin on Tue Apr 01 19:23:13 GMT 2025
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PUBCHEM
5484853
Created by admin on Tue Apr 01 19:23:13 GMT 2025 , Edited by admin on Tue Apr 01 19:23:13 GMT 2025
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EPA CompTox
DTXSID2070635
Created by admin on Tue Apr 01 19:23:13 GMT 2025 , Edited by admin on Tue Apr 01 19:23:13 GMT 2025
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ECHA (EC/EINECS)
267-195-4
Created by admin on Tue Apr 01 19:23:13 GMT 2025 , Edited by admin on Tue Apr 01 19:23:13 GMT 2025
PRIMARY
FDA UNII
QLS5RJ4YAU
Created by admin on Tue Apr 01 19:23:13 GMT 2025 , Edited by admin on Tue Apr 01 19:23:13 GMT 2025
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