1-(4'-HYDROXY-3'-HYDROXYMETHYL)-2-(BENZYL-TERT-BUTYLAMINO)ETHANONE HYDROCHLORIDE

Details

Stereochemistry	ACHIRAL
Molecular Formula	C20H25NO3.ClH
Molecular Weight	363.878
Optical Activity	NONE
Defined Stereocenters	0 / 0
E/Z Centers	0
Charge	0

SHOW SMILES / InChI

Structure of 1-(4'-HYDROXY-3'-HYDROXYMETHYL)-2-(BENZYL-TERT-BUTYLAMINO)ETHANONE HYDROCHLORIDE

Structure Search

SMILES

Cl.CC(C)(C)N(CC(=O)C1=CC=C(O)C(CO)=C1)CC2=CC=CC=C2

InChI

InChIKey=QXNITHCPVLQQEN-UHFFFAOYSA-N

InChI=1S/C20H25NO3.ClH/c1-20(2,3)21(12-15-7-5-4-6-8-15)13-19(24)16-9-10-18(23)17(11-16)14-22;/h4-11,22-23H,12-14H2,1-3H3;1H

HIDE SMILES / InChI

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

Molecular Formula	C20H25NO3
Molecular Weight	327.4174
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 22:02:40 GMT 2025` Edited by `admin` on `Mon Mar 31 22:02:40 GMT 2025`
Record UNII	HZH6XSQ72R
Record Status	`Validated (UNII)`
Record Version

Download

Name

Type

Language

1-(4'-HYDROXY-3'-HYDROXYMETHYL)-2-(BENZYL-TERT-BUTYLAMINO)ETHANONE HYDROCHLORIDE

Common Name

English

2-(Benzyl(tert-butyl)amino)-1-(4-hydroxy-3-(hydroxymethyl)phenyl)ethanone hydrochloride

Preferred Name

English

Ethanone, 2-[(1,1-dimethylethyl)(phenylmethyl)amino]-1-[4-hydroxy-3-(hydroxymethyl)phenyl]-, hydrochloride (1:1)

Systematic Name

English

Acetophenone, 2-(benzyl-tert-butylamino)-4?-hydroxy-3?-(hydroxymethyl)-, hydrochloride

Systematic Name

English

2-(Benzyl-tert-butylamino)-4?-hydroxy-3?-hydroxymethylacetophenone hydrochloride

Systematic Name

English

Code System Code Type Description

PUBCHEM

154872

Created by admin on Mon Mar 31 22:02:40 GMT 2025 , Edited by admin on Mon Mar 31 22:02:40 GMT 2025

PRIMARY

CAS

24085-08-3

Created by admin on Mon Mar 31 22:02:40 GMT 2025 , Edited by admin on Mon Mar 31 22:02:40 GMT 2025

PRIMARY

EPA CompTox

DTXSID00178814

Created by admin on Mon Mar 31 22:02:40 GMT 2025 , Edited by admin on Mon Mar 31 22:02:40 GMT 2025

PRIMARY

FDA UNII

HZH6XSQ72R

Created by admin on Mon Mar 31 22:02:40 GMT 2025 , Edited by admin on Mon Mar 31 22:02:40 GMT 2025

PRIMARY

Related Record Type Details


					B2X63QT035

N-BENZYLALBUTERONE

PARENT -> SALT/SOLVATE

Amount: