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Details

Stereochemistry ACHIRAL
Molecular Formula C8H12N5.Cl
Molecular Weight 213.667
Optical Activity NONE
Defined Stereocenters 0 / 0
E/Z Centers 0
Charge 0

SHOW SMILES / InChI
Structure of 6-PURINYLTRIMETHYLAMMONIUM CHLORIDE

SMILES

[Cl-].C[N+](C)(C)C1=C2N=CN=C2N=CN1

InChI

InChIKey=JSVIFNMHKUROQN-UHFFFAOYSA-M
InChI=1S/C8H12N5.ClH/c1-13(2,3)8-6-7(10-4-9-6)11-5-12-8;/h4-5H,1-3H3,(H,9,10,11,12);1H/q+1;/p-1

HIDE SMILES / InChI

Molecular Formula C8H12N5
Molecular Weight 178.2144
Charge 1
Count
Stereochemistry RACEMIC
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 Fri Dec 15 15:20:02 GMT 2023
Edited
by admin
on Fri Dec 15 15:20:02 GMT 2023
Record UNII
M0D2MM116H
Record Status Validated (UNII)
Record Version
  • Download
Name Type Language
6-PURINYLTRIMETHYLAMMONIUM CHLORIDE
Systematic Name English
9H-PURIN-6-AMINIUM, N,N,N-TRIMETHYL-, CHLORIDE (1:1)
Systematic Name English
1H-PUR6-TRIMETHYLAMINOPURINE CHLORIDE
Common Name English
TRIMETHYLPURIN-6-YLAMMONIUM CHLORIDE
Systematic Name English
AMMONIUM, TRIMETHYLPURIN-6-YL-, CHLORIDE
Systematic Name English
PURIN-6-YL-TRIMETHYLAMMONIUM CHLORIDE
Systematic Name English
1H-PURIN-6-AMINIUM, N,N,N-TRIMETHYL-, CHLORIDE
Systematic Name English
NSC-51095
Code English
Code System Code Type Description
ECHA (EC/EINECS)
235-880-7
Created by admin on Fri Dec 15 15:20:03 GMT 2023 , Edited by admin on Fri Dec 15 15:20:03 GMT 2023
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FDA UNII
M0D2MM116H
Created by admin on Fri Dec 15 15:20:03 GMT 2023 , Edited by admin on Fri Dec 15 15:20:03 GMT 2023
PRIMARY
CAS
13020-83-2
Created by admin on Fri Dec 15 15:20:03 GMT 2023 , Edited by admin on Fri Dec 15 15:20:03 GMT 2023
PRIMARY
EPA CompTox
DTXSID40926634
Created by admin on Fri Dec 15 15:20:03 GMT 2023 , Edited by admin on Fri Dec 15 15:20:03 GMT 2023
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NSC
51095
Created by admin on Fri Dec 15 15:20:03 GMT 2023 , Edited by admin on Fri Dec 15 15:20:03 GMT 2023
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PUBCHEM
5462820
Created by admin on Fri Dec 15 15:20:03 GMT 2023 , Edited by admin on Fri Dec 15 15:20:03 GMT 2023
PRIMARY
Related Record Type Details
PARENT -> SALT/SOLVATE