OCTAFONIUM

Details

Stereochemistry	ACHIRAL
Molecular Formula	C27H42NO
Molecular Weight	396.6285
Optical Activity	NONE
Defined Stereocenters	0 / 0
E/Z Centers	0
Charge	1

SHOW SMILES / InChI

Structure Search

SMILES

CC[N+](CC)(CCOC1=CC=C(C=C1)C(C)(C)CC(C)(C)C)CC2=CC=CC=C2

InChI

InChIKey=BSFQRHLBLCUWLG-UHFFFAOYSA-N

InChI=1S/C27H42NO/c1-8-28(9-2,21-23-13-11-10-12-14-23)19-20-29-25-17-15-24(16-18-25)27(6,7)22-26(3,4)5/h10-18H,8-9,19-22H2,1-7H3/q+1

HIDE SMILES / InChI

Molecular Formula	C27H42NO
Molecular Weight	396.6285
Charge	1
Count

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

Description
Sources: Elks J., The Dictionary of Drugs: Chemical Data: Chemical Data, Structures, retrieved from: https://books.google.ru/books?id=0vXTBwAAQBAJ&pg=PA895&lpg=PA895&dq=OCTAFONIUM&source=bl&ots=6JUer3TAqr&sig=ACfU3U3RLq8xfKbiTi-_u7q2pZnXL_JC6A&hl=ru&sa=X&ved=2ahUKEwjFzd69y-biAhVnwqYKHf-3A1w4FBDoATAEegQICRAB#v=onepage&q=OCTAFONIUM&f=false

Octafonium (or octaphonium) was used as an antiseptic. Information about the current use of this drug is not available.

Approval Year

Substance Class	Chemical Created by `admin` on `Fri Dec 15 15:59:30 GMT 2023` Edited by `admin` on `Fri Dec 15 15:59:30 GMT 2023`
Record UNII	6WS7SG5Y9L
Record Status	`Validated (UNII)`
Record Version

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Name

Type

Language

OCTAFONIUM

Common Name

English

OCTAFONIUM ION

Common Name

English

BENZYLDIETHYL(2-(4-(1,1,3,3-TETRAMETHYLBUTYL)PHENOXY)ETHYL)AMMONIUM

Systematic Name

English

OCTAFONIUM CATION

Common Name

English

Code System Code Type Description

CAS

6735-92-8

Created by admin on Fri Dec 15 15:59:30 GMT 2023 , Edited by admin on Fri Dec 15 15:59:30 GMT 2023

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PUBCHEM

66212

Created by admin on Fri Dec 15 15:59:30 GMT 2023 , Edited by admin on Fri Dec 15 15:59:30 GMT 2023

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FDA UNII

6WS7SG5Y9L

Created by admin on Fri Dec 15 15:59:30 GMT 2023 , Edited by admin on Fri Dec 15 15:59:30 GMT 2023

PRIMARY

EPA CompTox

DTXSID10217703

Created by admin on Fri Dec 15 15:59:30 GMT 2023 , Edited by admin on Fri Dec 15 15:59:30 GMT 2023

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					6WS7SG5Y9L

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ACTIVE MOIETY