1-BUTYL-1-METHYLPYRROLIDINIUM TETRAFLUOROBORATE

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NCATS

Details

Stereochemistry	ACHIRAL
Molecular Formula	C9H20N.BF4
Molecular Weight	229.066
Optical Activity	NONE
Defined Stereocenters	0 / 1
E/Z Centers	0
Charge	0

SHOW SMILES / InChI

Structure of 1-BUTYL-1-METHYLPYRROLIDINIUM TETRAFLUOROBORATE

Structure Search

SMILES

F[B-](F)(F)F.CCCC[N+]1(C)CCCC1

InChI

InChIKey=PGCVCJOPLBWQHU-UHFFFAOYSA-N

InChI=1S/C9H20N.BF4/c1-3-4-7-10(2)8-5-6-9-10;2-1(3,4)5/h3-9H2,1-2H3;/q+1;-1

HIDE SMILES / InChI

Molecular Formula	C9H20N
Molecular Weight	142.2618
Charge	1
Count

Stereochemistry	RACEMIC
Additional Stereochemistry	No
Defined Stereocenters	0 / 1
E/Z Centers	0
Optical Activity	NONE

Molecular Formula	BF4
Molecular Weight	86.805
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 `Mon Mar 31 19:04:21 GMT 2025` Edited by `admin` on `Mon Mar 31 19:04:21 GMT 2025`
Record UNII	092STD3PGH
Record Status	`Validated (UNII)`
Record Version

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Name

Type

Language

NSC-747254

Preferred Name

English

1-BUTYL-1-METHYLPYRROLIDINIUM TETRAFLUOROBORATE

Systematic Name

English

PYRROLIDINIUM, 1-BUTYL-1-METHYL-, TETRAFLUOROBORATE(1-) (1:1)

Systematic Name

English

N-BUTYL-N-METHYLPYRROLIDINIUM TETRAFLUOROBORATE

Systematic Name

English

Code System Code Type Description

PUBCHEM

44717198

Created by admin on Mon Mar 31 19:04:21 GMT 2025 , Edited by admin on Mon Mar 31 19:04:21 GMT 2025

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FDA UNII

092STD3PGH

Created by admin on Mon Mar 31 19:04:21 GMT 2025 , Edited by admin on Mon Mar 31 19:04:21 GMT 2025

PRIMARY

NSC

747254

Created by admin on Mon Mar 31 19:04:21 GMT 2025 , Edited by admin on Mon Mar 31 19:04:21 GMT 2025

PRIMARY

EPA CompTox

DTXSID6049276

Created by admin on Mon Mar 31 19:04:21 GMT 2025 , Edited by admin on Mon Mar 31 19:04:21 GMT 2025

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CAS

345984-11-4

Created by admin on Mon Mar 31 19:04:21 GMT 2025 , Edited by admin on Mon Mar 31 19:04:21 GMT 2025

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Related Record Type Details


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1-BUTYL-1-METHYLPYRROLIDINIUM CATION

PARENT -> SALT/SOLVATE