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+/-) -Octopamine hydrochloride

CAT: 0063-56592898-5gSize: 5 gDry Ice: NoHazardous: No
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CAT#:0063-56592898-5gSize:5 g
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CAS Number
770-05-8
Molecular Formula
C8H11NO2 · HCl
Molecular Weight
189.64
Formulation
C8H11NO2 · HCl

Chemical Information

Octopamine Hydrochloride

See also: Octopamine (has active moiety); (R)-Octopamine (annotation moved to).

CAS Number770-05-8
PubChem CID102484
IUPAC Name4-(2-amino-1-hydroxyethyl)phenol;hydrochloride
Molecular FormulaC8H12ClNO2
Molecular Weight189.64
Topological Polar Surface Area66.5
Hydrogen Bond Donor Count4
Hydrogen Bond Acceptor Count3
Rotatable Bond Count2
Heavy Atom Count12
Formal Charge0
Complexity111
SMILES
C1=CC(=CC=C1C(CN)O)O.Cl
InChI
InChI=1S/C8H11NO2.ClH/c9-5-8(11)6-1-3-7(10)4-2-6;/h1-4,8,10-11H,5,9H2;1H
InChIKey
PUMZXCBVHLCWQG-UHFFFAOYSA-N
Chemical Structure
2D Structure
2D structure of Octopamine Hydrochloride
CAS: 770-05-8
CID: 102484
Formula: C8H12ClNO2
MW: 189.64
Interactive 3D Structure
Loading 3D structure...
View on PubChemRaw 3D data
Computed Properties
PropertyValue
Molecular Weight189.64
Hydrogen Bond Donor Count4
Hydrogen Bond Acceptor Count3
Rotatable Bond Count2
Exact Mass189.0556563
Monoisotopic Mass189.0556563
Topological Polar Surface Area66.5 Ų
Heavy Atom Count12
Formal Charge0
Complexity111
Isotope Atom Count0
Defined Atom Stereocenter Count0
Undefined Atom Stereocenter Count1
Defined Bond Stereocenter Count0
Undefined Bond Stereocenter Count0
Covalently-Bonded Unit Count2
Compound Is CanonicalizedYes

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Alternative Products

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T0469-01Octopamine hydrochloride
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FR27566Rac Octopamine hydrochloride
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A13419-5000Octopamine hydrochloride 5g
A13419-1000Octopamine hydrochloride 1000mg
A13419-500Octopamine hydrochloride 500mg
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