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M-Tyramine hydrobromide 5mg

CAT: 0628-A19122-5Size: 5 mgDry Ice: NoHazardous: No
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CAT#:0628-A19122-5Size:5 mg
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CAS Number
38449-59-1

Chemical Information

3-(2-Aminoethyl)phenol hydrobromide
CAS Number38449-59-1
PubChem CID22717856
IUPAC Name3-(2-aminoethyl)phenol;hydrobromide
Molecular FormulaC8H12BrNO
Molecular Weight218.09
Topological Polar Surface Area46.3
Hydrogen Bond Donor Count3
Hydrogen Bond Acceptor Count2
Rotatable Bond Count2
Heavy Atom Count11
Formal Charge0
Complexity95
SMILES
C1=CC(=CC(=C1)O)CCN.Br
InChI
InChI=1S/C8H11NO.BrH/c9-5-4-7-2-1-3-8(10)6-7;/h1-3,6,10H,4-5,9H2;1H
InChIKey
RAMQGDMHEGTVQU-UHFFFAOYSA-N
Chemical Structure
2D Structure
2D structure of 3-(2-Aminoethyl)phenol hydrobromide
CAS: 38449-59-1
CID: 22717856
Formula: C8H12BrNO
MW: 218.09
Interactive 3D Structure
Loading 3D structure...
Computed Properties
PropertyValue
Molecular Weight218.09
Hydrogen Bond Donor Count3
Hydrogen Bond Acceptor Count2
Rotatable Bond Count2
Exact Mass217.01023
Monoisotopic Mass217.01023
Topological Polar Surface Area46.3 Ų
Heavy Atom Count11
Formal Charge0
Complexity95.3
Isotope Atom Count0
Defined Atom Stereocenter Count0
Undefined Atom Stereocenter Count0
Defined Bond Stereocenter Count0
Undefined Bond Stereocenter Count0
Covalently-Bonded Unit Count2
Compound Is CanonicalizedYes