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Details

Stereochemistry ACHIRAL
Molecular Formula C7H14ClN2.F6P
Molecular Weight 306.617
Optical Activity NONE
Defined Stereocenters 0 / 0
E/Z Centers 1
Charge 0

SHOW SMILES / InChI
Structure of 2-CHLORO-1,3-BIS(DIMETHYLAMINO)TRIMETHINIUM HEXAFLUOROPHOSPHATE

SMILES

F[P-](F)(F)(F)(F)F.CN(C)\C=C(/Cl)C=[N+](C)C

InChI

InChIKey=PIUHAULDXSPPQV-UHFFFAOYSA-N
InChI=1S/C7H14ClN2.F6P/c1-9(2)5-7(8)6-10(3)4;1-7(2,3,4,5)6/h5-6H,1-4H3;/q+1;-1

HIDE SMILES / InChI

Molecular Formula C7H14ClN2
Molecular Weight 161.652
Charge 1
Count
Stereochemistry ACHIRAL
Additional Stereochemistry No
Defined Stereocenters 0 / 0
E/Z Centers 1
Optical Activity NONE

Molecular Formula F6P
Molecular Weight 144.9642
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 15:46:45 UTC 2023
Edited
by admin
on Fri Dec 15 15:46:45 UTC 2023
Record UNII
X3ESZ1676P
Record Status Validated (UNII)
Record Version
  • Download
Name Type Language
2-CHLORO-1,3-BIS(DIMETHYLAMINO)TRIMETHINIUM HEXAFLUOROPHOSPHATE
Common Name English
ETORICOXIB RELATED COMPOUND C
USP-RS  
Common Name English
VINAMIDINIUM HEXAFLUROPHOPHATE
Common Name English
N-(2-CHLORO-3-(DIMETHYLAMINO)-2-PROPENYLIDENE)-N-METHYLMETHANAMINUIUM HEXAFLUOROPHOSPHATE
Common Name English
2-PROPEN-1-AMINIUM, 2-CHLORO-3-(DIMETHYLAMINO)-N,N-DIMETHYL-, (2Z)-, HEXAFLUOROPHOSPHATE(1-) (1:1)
Systematic Name English
METHANAMINIUM, N-((2Z)-2-CHLORO-3-(DIMETHYLAMINO)-2-PROPENYLIDENE)-N-METHYL-, HEXAFLUOROPHOSPHATE(1-)
Common Name English
METHANAMINIUM, N-(2-CHLORO-3-(DIMETHYLAMINO)-2-PROPENYLIDENE)-N-METHYL-, HEXAFLUOROPHOSPHATE(1-)
Systematic Name English
Code System Code Type Description
PUBCHEM
10590807
Created by admin on Fri Dec 15 15:46:45 UTC 2023 , Edited by admin on Fri Dec 15 15:46:45 UTC 2023
PRIMARY
CAS
249561-98-6
Created by admin on Fri Dec 15 15:46:45 UTC 2023 , Edited by admin on Fri Dec 15 15:46:45 UTC 2023
NON-SPECIFIC STEREOCHEMISTRY
EPA CompTox
DTXSID50947830
Created by admin on Fri Dec 15 15:46:45 UTC 2023 , Edited by admin on Fri Dec 15 15:46:45 UTC 2023
PRIMARY
ECHA (EC/EINECS)
619-785-1
Created by admin on Fri Dec 15 15:46:45 UTC 2023 , Edited by admin on Fri Dec 15 15:46:45 UTC 2023
PRIMARY
FDA UNII
X3ESZ1676P
Created by admin on Fri Dec 15 15:46:45 UTC 2023 , Edited by admin on Fri Dec 15 15:46:45 UTC 2023
PRIMARY
CAS
291756-76-8
Created by admin on Fri Dec 15 15:46:45 UTC 2023 , Edited by admin on Fri Dec 15 15:46:45 UTC 2023
PRIMARY
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