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Details

Stereochemistry MIXED
Molecular Formula C13H21NO3.ClH
Molecular Weight 275.772
Optical Activity UNSPECIFIED
Defined Stereocenters 0 / 2
E/Z Centers 0
Charge 0

SHOW SMILES / InChI
Structure of .BETA.-(2,5-DIETHOXYPHENYL)-.BETA.-HYDROXYISOPROPYLAMINE, HYDROCHLORIDE

SMILES

Cl.CCOC1=CC=C(OCC)C(=C1)C(O)C(C)N

InChI

InChIKey=LAZIJOOPOWFIQW-UHFFFAOYSA-N
InChI=1S/C13H21NO3.ClH/c1-4-16-10-6-7-12(17-5-2)11(8-10)13(15)9(3)14;/h6-9,13,15H,4-5,14H2,1-3H3;1H

HIDE SMILES / InChI

Molecular Formula C13H21NO3
Molecular Weight 239.3107
Charge 0
Count
Stereochemistry MIXED
Additional Stereochemistry No
Defined Stereocenters 0 / 2
E/Z Centers 0
Optical Activity UNSPECIFIED

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

Approval Year

Substance Class Chemical
Created
by admin
on Mon Mar 31 17:47:38 GMT 2025
Edited
by admin
on Mon Mar 31 17:47:38 GMT 2025
Record UNII
I7P05E3UD7
Record Status Validated (UNII)
Record Version
  • Download
Name Type Language
2,5-DIETHOXY NOREPHEDRINE HYDROBROMIDE, (±)-
Preferred Name English
.BETA.-(2,5-DIETHOXYPHENYL)-.BETA.-HYDROXYISOPROPYLAMINE, HYDROCHLORIDE
Systematic Name English
BENZENEMETHANOL, .ALPHA.-(1-AMINOETHYL)-2,5-DIETHOXY-, HYDROCHLORIDE (1:1)
Systematic Name English
Code System Code Type Description
CAS
22200-06-2
Created by admin on Mon Mar 31 17:47:38 GMT 2025 , Edited by admin on Mon Mar 31 17:47:38 GMT 2025
PRIMARY
FDA UNII
I7P05E3UD7
Created by admin on Mon Mar 31 17:47:38 GMT 2025 , Edited by admin on Mon Mar 31 17:47:38 GMT 2025
PRIMARY
PUBCHEM
19995435
Created by admin on Mon Mar 31 17:47:38 GMT 2025 , Edited by admin on Mon Mar 31 17:47:38 GMT 2025
PRIMARY
Related Record Type Details
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