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D-α-Aminoxy-β-phenylpropionic Acid Hydrobromide

CAT: 0024-sc-211187Size: 50 mgDry Ice: NoHazardous: No
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CAT#:0024-sc-211187Size:50 mg
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CAS Number
73086-98-3

Chemical Information

(2R)-2-(Aminooxy)-3-phenylpropanoic acid hydrobromide
CAS Number73086-98-3
PubChem CID44119299
IUPAC Name(2R)-2-aminooxy-3-phenylpropanoic acid;hydrobromide
Molecular FormulaC9H12BrNO3
Molecular Weight262.10
Topological Polar Surface Area72.6
Hydrogen Bond Donor Count3
Hydrogen Bond Acceptor Count4
Rotatable Bond Count4
Heavy Atom Count14
Formal Charge0
Complexity166
SMILES
C1=CC=C(C=C1)C[C@H](C(=O)O)ON.Br
InChI
InChI=1S/C9H11NO3.BrH/c10-13-8(9(11)12)6-7-4-2-1-3-5-7;/h1-5,8H,6,10H2,(H,11,12);1H/t8-;/m1./s1
InChIKey
YENJJZAVLSPBIZ-DDWIOCJRSA-N
Chemical Structure
2D Structure
2D structure of (2R)-2-(Aminooxy)-3-phenylpropanoic acid hydrobromide
CAS: 73086-98-3
CID: 44119299
Formula: C9H12BrNO3
MW: 262.10
Interactive 3D Structure
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Computed Properties
PropertyValue
Molecular Weight262.10
Hydrogen Bond Donor Count3
Hydrogen Bond Acceptor Count4
Rotatable Bond Count4
Exact Mass261.00006
Monoisotopic Mass261.00006
Topological Polar Surface Area72.6 Ų
Heavy Atom Count14
Formal Charge0
Complexity166
Isotope Atom Count0
Defined Atom Stereocenter Count1
Undefined Atom Stereocenter Count0
Defined Bond Stereocenter Count0
Undefined Bond Stereocenter Count0
Covalently-Bonded Unit Count2
Compound Is CanonicalizedYes