Bisoprolol Impurity 14 HCl

CAT: 1596-AR-B07391-01Size: 10 UnitsDry Ice: NoHazardous: No

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CAT#:1596-AR-B07391-01Size:10 Units

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CAS Number

2829-84-7

Synonyms

4- (2-Hydroxy-3- (isopropylamino) propoxy) phenol, hydrochloride (1:1)

Molecular Formula

C12H19NO3. HCl

Molecular Weight

225.29 36.46

API Name

Bisoprolol

Chemical Information

4-[2-Hydroxy-3-[(1-methylethyl)amino]propoxy]phenol hydrochloride

See also: Prenalterol Hydrochloride (annotation moved to).

CAS Number	2829-84-7
PubChem CID	3014135
IUPAC Name	4-[2-hydroxy-3-(propan-2-ylamino)propoxy]phenol;hydrochloride
Molecular Formula	C12H20ClNO3
Molecular Weight	261.74
Topological Polar Surface Area	61.7
Hydrogen Bond Donor Count	4
Hydrogen Bond Acceptor Count	4
Rotatable Bond Count	6
Heavy Atom Count	17
Formal Charge	0
Complexity	179

SMILES

CC(C)NCC(COC1=CC=C(C=C1)O)O.Cl

InChI

InChI=1S/C12H19NO3.ClH/c1-9(2)13-7-11(15)8-16-12-5-3-10(14)4-6-12;/h3-6,9,11,13-15H,7-8H2,1-2H3;1H

InChIKey

WDXYIFGETVGLBZ-UHFFFAOYSA-N

Chemical Structure

2D Structure

CAS: 2829-84-7

CID: 3014135

Formula: C12H20ClNO3

MW: 261.74

Interactive 3D Structure

Loading 3D structure...

Computed Properties

Property	Value
Molecular Weight	261.74
Hydrogen Bond Donor Count	4
Hydrogen Bond Acceptor Count	4
Rotatable Bond Count	6
Exact Mass	261.1131712
Monoisotopic Mass	261.1131712
Topological Polar Surface Area	61.7 Å²
Heavy Atom Count	17
Formal Charge	0
Complexity	179
Isotope Atom Count	0
Defined Atom Stereocenter Count	0
Undefined Atom Stereocenter Count	1
Defined Bond Stereocenter Count	0
Undefined Bond Stereocenter Count	0
Covalently-Bonded Unit Count	2
Compound Is Canonicalized	Yes

Catalog	Name
AR-B05841-01	Bisoprolol Acid Impurity HCl Salt (Racemic)
AR-B01745-01	Bisoprolol Impurity *
AR-B01746-01	Bisoprolol Impurity E (Dehydroxy Bisoprolol)
AR-F10451-01	Flupentixol Impurity 14 HCl
AR-F09610-01	Famotidine Impurity 14 HCl
AR-S10164-01	Sertraline Impurity 14 HCl
AR-D07923-01	Dyclonine Impurity 14 HCl
AR-C02844-01	Cinacalcet Impurity 14 HCl
AR-B05892-01	Baclofen Impurity 14 HCl
AR-B07768-01	Brivudine Impurity 14 HCl

Catalog	Name
RM-B191601-01	Bisoprolol EP Impurity A; Bisoprolol USP Rc A
RM-B191666-01	Bisoprolol Impurity 66
RM-B191683-01	Bisoprolol Impurity 83
RM-B191682-01	Bisoprolol Impurity 82
RM-B191681-01	Bisoprolol Impurity 81
RM-B191673-01	Bisoprolol Impurity 73
RM-B191671-01	Bisoprolol Impurity 71
RM-B191625-01	Bisoprolol Impurity 25
RM-B191627-01	Bisoprolol Impurity 27
RM-B191631-01	Bisoprolol Impurity 31