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Clobutinol hydrochloride

CAT: 0931-T78523-01Size: 5 mgDry Ice: NoHazardous: No
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CAT#:0931-T78523-01Size:5 mg
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CAS Number
1215-83-4
Target
Potassium Channel
Related Pathways
Membrane transporter/Ion channel
Bioactivity
Clobutinol hydrochloride, an antitussive agent, influences heart rate and blood pressure, and is utilized in cough-related research [1] [2] [3].
Smiles
Cl.ClC1=CC=C(C=C1)CC(O)(C)C(C)CN(C)C
Molecular Formula
C14H23Cl2NO
Molecular Weight
292.25
Shipping Conditions
Ice Packs
Storage Temperature
-20°C

Chemical Information

Clobutinol Hydrochloride

Clobutinol hydrochloride is a member of benzenes and an organic amino compound.

CAS Number1215-83-4
PubChem CID92876
IUPAC Name1-(4-chlorophenyl)-4-(dimethylamino)-2,3-dimethylbutan-2-ol;hydrochloride
Molecular FormulaC14H23Cl2NO
Molecular Weight292.2
Topological Polar Surface Area23.5
Hydrogen Bond Donor Count2
Hydrogen Bond Acceptor Count2
Rotatable Bond Count5
Heavy Atom Count18
Formal Charge0
Complexity226
SMILES
CC(CN(C)C)C(C)(CC1=CC=C(C=C1)Cl)O.Cl
InChI
InChI=1S/C14H22ClNO.ClH/c1-11(10-16(3)4)14(2,17)9-12-5-7-13(15)8-6-12;/h5-8,11,17H,9-10H2,1-4H3;1H
InChIKey
ZMROYCGIWPNZNJ-UHFFFAOYSA-N
Chemical Structure
2D Structure
2D structure of Clobutinol Hydrochloride
CAS: 1215-83-4
CID: 92876
Formula: C14H23Cl2NO
MW: 292.2
Interactive 3D Structure
Loading 3D structure...
Computed Properties
PropertyValue
Molecular Weight292.2
Hydrogen Bond Donor Count2
Hydrogen Bond Acceptor Count2
Rotatable Bond Count5
Exact Mass291.1156697
Monoisotopic Mass291.1156697
Topological Polar Surface Area23.5 Ų
Heavy Atom Count18
Formal Charge0
Complexity226
Isotope Atom Count0
Defined Atom Stereocenter Count0
Undefined Atom Stereocenter Count2
Defined Bond Stereocenter Count0
Undefined Bond Stereocenter Count0
Covalently-Bonded Unit Count2
Compound Is CanonicalizedYes