Zilpaterol HCl

CAT: 1596-AR-Z01238-01Size: 25 UnitsDry Ice: NoHazardous: No

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CAT#:1596-AR-Z01238-01Size:25 Units

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CAS Number

119520-06-8

Synonyms

Rel- (6R,7R) -6-hydroxy-7- (isopropylamino) -6,7,8,9-tetrahydro-2,9a-diazabenzo[cd]azulen-1 (2H) -one, hydrochloride (1:1) ; Imidazo[4,5,1-jk][1]benzazepin-2 (1H) -one, 4,5,6,7-tetrahydro-7-hydroxy-6-[ (1-methylethyl) amino]-, hydrochloride (1:1), (6R,7R) -rel- (ACI)

Molecular Formula

C14H19N3O2. HCl

Molecular Weight

261.33 36.46

API Name

Zilpaterol

Chemical Information

Zilpaterol Hydrochloride

See also: Zilpaterol (has active moiety); Melengestrol Acetate; Zilpaterol Hydrochloride (component of) ... View More ...

CAS Number	119520-06-8
PubChem CID	11507658
IUPAC Name	(9R,10R)-9-hydroxy-10-(propan-2-ylamino)-1,3-diazatricyclo[6.4.1.04,13]trideca-4,6,8(13)-trien-2-one;hydrochloride
Molecular Formula	C14H20ClN3O2
Molecular Weight	297.78
Topological Polar Surface Area	64.6
Hydrogen Bond Donor Count	4
Hydrogen Bond Acceptor Count	3
Rotatable Bond Count	2
Heavy Atom Count	20
Formal Charge	0
Complexity	361

SMILES

CC(C)N[C@@H]1CCN2C3=C([C@H]1O)C=CC=C3NC2=O.Cl

InChI

InChI=1S/C14H19N3O2.ClH/c1-8(2)15-11-6-7-17-12-9(13(11)18)4-3-5-10(12)16-14(17)19;/h3-5,8,11,13,15,18H,6-7H2,1-2H3,(H,16,19);1H/t11-,13-;/m1./s1

InChIKey

GIEFXLLRTJNFGT-LOCPCMAASA-N

Chemical Structure

2D Structure

CAS: 119520-06-8

CID: 11507658

Formula: C14H20ClN3O2

MW: 297.78

Interactive 3D Structure

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Computed Properties

Property	Value
Molecular Weight	297.78
Hydrogen Bond Donor Count	4
Hydrogen Bond Acceptor Count	3
Rotatable Bond Count	2
Exact Mass	297.1244046
Monoisotopic Mass	297.1244046
Topological Polar Surface Area	64.6 Å²
Heavy Atom Count	20
Formal Charge	0
Complexity	361
Isotope Atom Count	0
Defined Atom Stereocenter Count	2
Undefined Atom Stereocenter Count	0
Defined Bond Stereocenter Count	0
Undefined Bond Stereocenter Count	0
Covalently-Bonded Unit Count	2
Compound Is Canonicalized	Yes

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Catalog	Name
C3632-5	Zilpaterol
80-1327	Zilpaterol-HRP
CS-T-62833	Zilpaterol-d7
CS-T-103592	Zilpaterol-13C3
MBS5756476-01	Zilpaterol hydrochloride
abx284033	Zilpaterol (HRP)
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Zilpaterol HCl

Chemical Information

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