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Details

Stereochemistry ACHIRAL
Molecular Formula C7H14N.ClO4
Molecular Weight 211.643
Optical Activity NONE
Defined Stereocenters 0 / 0
E/Z Centers 0
Charge 0

SHOW SMILES / InChI
Structure of 1-ETHYL-3,4-DIHYDRO-5-METHYL-2H-PYRROLIUM PERCHLORATE

SMILES

[O-]Cl(=O)(=O)=O.CC[N+]1=C(C)CCC1

InChI

InChIKey=ADUUDJKUUDLKRM-UHFFFAOYSA-M
InChI=1S/C7H14N.ClHO4/c1-3-8-6-4-5-7(8)2;2-1(3,4)5/h3-6H2,1-2H3;(H,2,3,4,5)/q+1;/p-1

HIDE SMILES / InChI

Molecular Formula ClO4
Molecular Weight 99.451
Charge -1
Count
Stereochemistry ACHIRAL
Additional Stereochemistry No
Defined Stereocenters 0 / 0
E/Z Centers 0
Optical Activity NONE

Molecular Formula C7H14N
Molecular Weight 112.1928
Charge 1
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 17:52:56 GMT 2025
Edited
by admin
on Tue Apr 01 17:52:56 GMT 2025
Record UNII
AB8FGB4XYY
Record Status Validated (UNII)
Record Version
  • Download
Name Type Language
1-ETHYL-3,4-DIHYDRO-5-METHYL-2H-PYRROLIUM PERCHLORATE
Systematic Name English
2H-PYRROLIUM, 1-ETHYL-3,4-DIHYDRO-5-METHYL-, PERCHLORATE
Preferred Name English
2H-PYRROLIUM, 1-ETHYL-3,4-DIHYDRO-5-METHYL-, PERCHLORATE (1:1)
Systematic Name English
Code System Code Type Description
CAS
67990-15-2
Created by admin on Tue Apr 01 17:52:56 GMT 2025 , Edited by admin on Tue Apr 01 17:52:56 GMT 2025
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EPA CompTox
DTXSID5070949
Created by admin on Tue Apr 01 17:52:56 GMT 2025 , Edited by admin on Tue Apr 01 17:52:56 GMT 2025
PRIMARY
ECHA (EC/EINECS)
268-038-2
Created by admin on Tue Apr 01 17:52:56 GMT 2025 , Edited by admin on Tue Apr 01 17:52:56 GMT 2025
PRIMARY
FDA UNII
AB8FGB4XYY
Created by admin on Tue Apr 01 17:52:56 GMT 2025 , Edited by admin on Tue Apr 01 17:52:56 GMT 2025
PRIMARY
PUBCHEM
106309
Created by admin on Tue Apr 01 17:52:56 GMT 2025 , Edited by admin on Tue Apr 01 17:52:56 GMT 2025
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