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Details

Stereochemistry ACHIRAL
Molecular Formula C6H5ClN4
Molecular Weight 168.584
Optical Activity NONE
Defined Stereocenters 0 / 0
E/Z Centers 0
Charge 0

SHOW SMILES / InChI
Structure of 6-Chloro-9-methylpurine

SMILES

CN1C=NC2=C1N=CN=C2Cl

InChI

InChIKey=UEZNSCCMEMUEMO-UHFFFAOYSA-N
InChI=1S/C6H5ClN4/c1-11-3-10-4-5(7)8-2-9-6(4)11/h2-3H,1H3

HIDE SMILES / InChI

Molecular Formula C6H5ClN4
Molecular Weight 168.584
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 19:42:22 GMT 2025
Edited
by admin
on Tue Apr 01 19:42:22 GMT 2025
Record UNII
NLB9WGW9W5
Record Status Validated (UNII)
Record Version
  • Download
Name Type Language
6-Chloro-9-methylpurine
Systematic Name English
NSC-4948
Preferred Name English
9-Methyl-6-chloropurine
Systematic Name English
9H-Purine, 6-chloro-9-methyl-
Systematic Name English
6-Chloro-9-methyl-9H-purine
Systematic Name English
Code System Code Type Description
PUBCHEM
94844
Created by admin on Tue Apr 01 19:42:22 GMT 2025 , Edited by admin on Tue Apr 01 19:42:22 GMT 2025
PRIMARY
FDA UNII
NLB9WGW9W5
Created by admin on Tue Apr 01 19:42:22 GMT 2025 , Edited by admin on Tue Apr 01 19:42:22 GMT 2025
PRIMARY
NSC
4948
Created by admin on Tue Apr 01 19:42:22 GMT 2025 , Edited by admin on Tue Apr 01 19:42:22 GMT 2025
PRIMARY
CAS
2346-74-9
Created by admin on Tue Apr 01 19:42:22 GMT 2025 , Edited by admin on Tue Apr 01 19:42:22 GMT 2025
PRIMARY
EPA CompTox
DTXSID60178012
Created by admin on Tue Apr 01 19:42:22 GMT 2025 , Edited by admin on Tue Apr 01 19:42:22 GMT 2025
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