U.S. Department of Health & Human Services Divider Arrow National Institutes of Health Divider Arrow NCATS

Details

Stereochemistry ACHIRAL
Molecular Formula C9H11NO2.ClH
Molecular Weight 201.65
Optical Activity NONE
Defined Stereocenters 0 / 0
E/Z Centers 0
Charge 0

SHOW SMILES / InChI
Structure of PHENYLEPHRONE HYDROCHLORIDE

SMILES

Cl.CNCC(=O)C1=CC(O)=CC=C1

InChI

InChIKey=DEOGEZWYKPQJLP-UHFFFAOYSA-N
InChI=1S/C9H11NO2.ClH/c1-10-6-9(12)7-3-2-4-8(11)5-7;/h2-5,10-11H,6H2,1H3;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 C9H11NO2
Molecular Weight 165.1891
Charge 0
Count
Stereochemistry ACHIRAL
Additional Stereochemistry No
Defined Stereocenters 0 / 0
E/Z Centers 0
Optical Activity NONE

Approval Year

Patents
Substance Class Chemical
Created
by admin
on Sat Dec 16 10:33:06 GMT 2023
Edited
by admin
on Sat Dec 16 10:33:06 GMT 2023
Record UNII
D90VCA2N0S
Record Status Validated (UNII)
Record Version
  • Download
Name Type Language
PHENYLEPHRONE HYDROCHLORIDE
Common Name English
ETHANONE, 1-(3-HYDROXYPHENYL)-2-(METHYLAMINO)-, HYDROCHLORIDE (1:1)
Systematic Name English
ETHANONE, 1-(3-HYDROXYPHENYL)-2-(METHYLAMINO)-, HYDROCHLORIDE
Systematic Name English
1-(3-HYDROXYPHENYL)-2-(METHYLAMINO)ETHANONE HYDROCHLORIDE
Systematic Name English
Code System Code Type Description
RS_ITEM_NUM
1533024
Created by admin on Sat Dec 16 10:33:06 GMT 2023 , Edited by admin on Sat Dec 16 10:33:06 GMT 2023
PRIMARY
CAS
94240-17-2
Created by admin on Sat Dec 16 10:33:06 GMT 2023 , Edited by admin on Sat Dec 16 10:33:06 GMT 2023
PRIMARY
FDA UNII
D90VCA2N0S
Created by admin on Sat Dec 16 10:33:06 GMT 2023 , Edited by admin on Sat Dec 16 10:33:06 GMT 2023
PRIMARY
EPA CompTox
DTXSID70241221
Created by admin on Sat Dec 16 10:33:06 GMT 2023 , Edited by admin on Sat Dec 16 10:33:06 GMT 2023
PRIMARY
PUBCHEM
3024110
Created by admin on Sat Dec 16 10:33:06 GMT 2023 , Edited by admin on Sat Dec 16 10:33:06 GMT 2023
PRIMARY
Related Record Type Details
PARENT -> SALT/SOLVATE