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Details

Stereochemistry RACEMIC
Molecular Formula C14H21NO.BrH
Molecular Weight 300.235
Optical Activity ( + / - )
Defined Stereocenters 0 / 1
E/Z Centers 0
Charge 0

SHOW SMILES / InChI
Structure of Preclamol hydrobromide, (±)-

SMILES

Br.CCCN1CCCC(C1)C2=CC(O)=CC=C2

InChI

InChIKey=PNBOVBWIGKATIC-UHFFFAOYSA-N
InChI=1S/C14H21NO.BrH/c1-2-8-15-9-4-6-13(11-15)12-5-3-7-14(16)10-12;/h3,5,7,10,13,16H,2,4,6,8-9,11H2,1H3;1H

HIDE SMILES / InChI

Molecular Formula BrH
Molecular Weight 80.912
Charge 0
Count
Stereochemistry ACHIRAL
Additional Stereochemistry No
Defined Stereocenters 0 / 0
E/Z Centers 0
Optical Activity NONE

Molecular Formula C14H21NO
Molecular Weight 219.3226
Charge 0
Count
Stereochemistry RACEMIC
Additional Stereochemistry No
Defined Stereocenters 0 / 1
E/Z Centers 0
Optical Activity ( + / - )

Approval Year

Substance Class Chemical
Created
by admin
on Sat Dec 16 19:17:11 GMT 2023
Edited
by admin
on Sat Dec 16 19:17:11 GMT 2023
Record UNII
F65RHP5XLA
Record Status Validated (UNII)
Record Version
  • Download
Name Type Language
Preclamol hydrobromide, (±)-
Common Name English
3-(1-propyl-3-piperidinyl)phenol hydrobromide
Systematic Name English
Phenol, 3-(1-propyl-3-piperidinyl)-, hydrobromide (1:1)
Systematic Name English
Phenol, 3-(1-propyl-3-piperidinyl)-, hydrobromide
Systematic Name English
Code System Code Type Description
FDA UNII
F65RHP5XLA
Created by admin on Sat Dec 16 19:17:11 GMT 2023 , Edited by admin on Sat Dec 16 19:17:11 GMT 2023
PRIMARY
PUBCHEM
23045647
Created by admin on Sat Dec 16 19:17:11 GMT 2023 , Edited by admin on Sat Dec 16 19:17:11 GMT 2023
PRIMARY
CAS
79412-27-4
Created by admin on Sat Dec 16 19:17:11 GMT 2023 , Edited by admin on Sat Dec 16 19:17:11 GMT 2023
PRIMARY
Related Record Type Details
PARENT -> SALT/SOLVATE