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Details

Stereochemistry RACEMIC
Molecular Formula C12H20N2O3.ClH
Molecular Weight 276.76
Optical Activity ( + / - )
Defined Stereocenters 0 / 1
E/Z Centers 0
Charge 0

SHOW SMILES / InChI
Structure of PIRBUTEROL MONOHYDROCHLORIDE

SMILES

Cl.CC(C)(C)NCC(O)C1=NC(CO)=C(O)C=C1

InChI

InChIKey=GPDAJAWUGSTOSA-UHFFFAOYSA-N
InChI=1S/C12H20N2O3.ClH/c1-12(2,3)13-6-11(17)8-4-5-10(16)9(7-15)14-8;/h4-5,11,13,15-17H,6-7H2,1-3H3;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 C12H20N2O3
Molecular Weight 240.2988
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 11:25:37 UTC 2023
Edited
by admin
on Sat Dec 16 11:25:37 UTC 2023
Record UNII
GR436K4GK8
Record Status Validated (UNII)
Record Version
  • Download
Name Type Language
PIRBUTEROL MONOHYDROCHLORIDE
Common Name English
2,6-PYRIDINEDIMETHANOL, .ALPHA.6-(((1,1-DIMETHYLETHYL)AMINO)METHYL)-3-HYDROXY-, HYDROCHLORIDE (1:1)
Systematic Name English
2,6-PYRIDINEDIMETHANOL, .ALPHA.6-(((1,1-DIMETHYLETHYL)AMINO)METHYL)-3-HYDROXY-, MONOHYDROCHLORIDE, (±)-
Common Name English
2,6-PYRIDINEDIMETHANOL, .ALPHA.6-(((1,1-DIMETHYLETHYL)AMINO)METHYL)-3-HYDROXY-, MONOHYDROCHLORIDE
Common Name English
Code System Code Type Description
FDA UNII
GR436K4GK8
Created by admin on Sat Dec 16 11:25:37 UTC 2023 , Edited by admin on Sat Dec 16 11:25:37 UTC 2023
PRIMARY
EPA CompTox
DTXSID70905472
Created by admin on Sat Dec 16 11:25:37 UTC 2023 , Edited by admin on Sat Dec 16 11:25:37 UTC 2023
PRIMARY
CAS
79645-08-2
Created by admin on Sat Dec 16 11:25:37 UTC 2023 , Edited by admin on Sat Dec 16 11:25:37 UTC 2023
PRIMARY
PUBCHEM
3061720
Created by admin on Sat Dec 16 11:25:37 UTC 2023 , Edited by admin on Sat Dec 16 11:25:37 UTC 2023
PRIMARY